SCHEMBL104326

SCHEMBL104326

CC(C)c1ccc(OCCN2CCOCC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.70
▸ KMT2A Q03164 3/20 0.70
▸ NPC1 O15118 3/20 0.70
▸ RAB9A P51151 2/20 0.70
▸ ALDH1A1 P00352 4/20 0.65
▸ MAPK1 P28482 2/20 0.61
▸ CYP1A2 P05177 1/20 0.61
▸ CHRM2 P08172 1/20 0.61
▸ CHRM1 P11229 1/20 0.61
▸ HTR2A P28223 1/20 0.61
▸ SCN1A P35498 1/20 0.61
▸ HTR2B P41595 1/20 0.61
▸ KCNH2 Q12809 1/20 0.61
▸ SCN2A Q99250 1/20 0.61
▸ SIGMAR1 Q99720 1/20 0.61
▸ SCN3A Q9NY46 1/20 0.61
▸ HRH3 Q9Y5N1 1/20 0.61
▸ KDM4E B2RXH2 2/20 0.61
▸ PSMB1 P20618 1/20 0.60
▸ PSMB5 P28074 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10223326 0.93 MEN1 (0.77) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL12204134 0.88 PSMB1 (0.64) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL23742316 0.87 ALDH1A1 (0.85) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL15701621 0.86 MEN1 (0.62) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL23474922 0.86 MEN1 (0.79) MEN1KMT2AALDH1A1HRH3KDM4E
SCHEMBL11977007 0.86 MEN1 (0.85) MEN1KMT2AALDH1A1HRH3KDM4E
SCHEMBL23742277 0.85 ALDH1A1 (0.66) NPC1RAB9AALDH1A1MAPK1CYP1A2
SCHEMBL15630158 0.85 MEN1 (0.64) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL20409783 0.85 ALDH1A1 (0.62) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL12015814 0.84 MEN1 (0.68) MEN1KMT2ANPC1RAB9AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 — — US disclosed
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 — — US disclosed
US-11725011-B2 Bicyclic urea kinase inhibitors and uses thereof THE GENERAL HOSPITAL CORPORATION (US) 2023-08-15 — — US disclosed
US-20230234959-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2023-07-27 — — US disclosed
US-20220305016-A1 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS FOR TREATING OSTEOPOROSIS THE GENERAL HOSPITAL CORPORATION (US) 2022-09-29 — — US disclosed
US-20220133736-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS THE GENERAL HOSPITAL CORPORATION (US) 2022-05-05 — — US disclosed
US-11241435-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis THE GENERAL HOSPITAL CORPORATION (US) 2022-02-08 — — US disclosed
US-20210299115-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-09-30 — — US disclosed
US-11026937-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2021-06-08 — — US disclosed
US-20210147425-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2021-05-20 — — US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 — — US disclosed
US-8084618-B2 Heterocyclic compounds and methods of use TARGEGEN, INC. (US) 2011-12-27 — — US disclosed
US-20100330069-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE TARGEGEN, INC. (US) 2010-12-30 — — US disclosed
US-7652051-B2 Heterocyclic compounds and methods of use TARGEGEN, INC. (US) 2010-01-26 — — US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 — — US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 — — US disclosed
US-20080064718-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2008-03-13 — — US disclosed
US-20080004273-A1 Inhibitors of protein tyrosine kinase activity METHYLGENE, INC. (CA) 2008-01-03 — — US disclosed
US-20070087346-A1 Orthogonal gene switches CILIBERTO GENNARO 2007-04-19 — — US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators PDE4A, PDE4B, PDE5A MEN1 4307/4885KMT2A 4505/4885NPC1 1428/4885
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 MEN1 3655/4885KMT2A 3391/4885NPC1 1129/4885
US-20220133736-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS SIK2, SIK1, SIK3 MEN1 4515/4885KMT2A 2339/4885NPC1 3810/4885
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 MEN1 1165/4885KMT2A 811/4885NPC1 2863/4885
US-20210147425-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF SIK1, SIK2, SIK3 MEN1 4510/4885KMT2A 2771/4885NPC1 3443/4885
US-20080064718-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET MEN1 3231/4885KMT2A 2353/4885NPC1 3563/4885
US-20220305016-A1 USES OF SALT-INDUCIBLE KINASE (SIK) INHIBITORS FOR TREATING OSTEOPOROSIS SOST, SIK2, SIK1 MEN1 3184/4885KMT2A 1338/4885NPC1 2544/4885
US-20210299115-A1 HETEROARYL INHIBITORS OF PAD4 PADI4, PADI1, PADI6 MEN1 4025/4885KMT2A 282/4885NPC1 1597/4885
US-11026937-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 MEN1 4025/4885KMT2A 282/4885NPC1 1597/4885
US-11241435-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis SOST, SIK2, SIK1 MEN1 3184/4885KMT2A 1338/4885NPC1 2544/4885
US-20230234959-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF SIK1, SIK2, SIK3 MEN1 4493/4885KMT2A 2530/4885NPC1 3623/4885
US-20100330069-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AADAC, NISCH, PAICS MEN1 1802/4885KMT2A 2017/4885NPC1 3400/4885
US-20080004273-A1 Inhibitors of protein tyrosine kinase activity HGF, ERBB2, MET MEN1 3231/4885KMT2A 2353/4885NPC1 3563/4885
US-11725011-B2 Bicyclic urea kinase inhibitors and uses thereof SIK1, SIK2, SIK3 MEN1 4493/4885KMT2A 2530/4885NPC1 3623/4885
US-20070087346-A1 Orthogonal gene switches TCF12, JUN, TCF7 MEN1 3645/4885KMT2A 567/4885NPC1 3808/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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