SCHEMBL955547

SCHEMBL955547

CN1CCN(C(=O)OCc2ccccc2)CC1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ TMEM97 Q5BJF2 10/20 0.52
▸ SIGMAR1 Q99720 10/20 0.52
▸ HTR1A P08908 1/20 0.52
▸ ADRA2A P08913 1/20 0.52
▸ ADRA2B P18089 1/20 0.52
▸ ADRA2C P18825 1/20 0.52
▸ DRD1 P21728 1/20 0.52
▸ HRH2 P25021 1/20 0.52
▸ HTR1B P28222 1/20 0.52
▸ HTR2A P28223 1/20 0.52
▸ HTR2C P28335 1/20 0.52
▸ HTR1E P28566 1/20 0.52
▸ SLC6A4 P31645 1/20 0.52
▸ HRH1 P35367 1/20 0.52

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
SCHEMBL12021864 0.89 MEN1 (0.58) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL9354661 0.84 TMEM97 (0.40) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL9354656 0.84 TMEM97 (0.40) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL16475199 0.84 TMEM97 (0.52) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL18123323 0.84 MEN1 (0.50) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL5729540 0.83 MEN1 (0.55) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL16132827 0.83 MEN1 (0.51) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL2674901 0.83 MEN1 (0.51) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL20812231 0.83 MEN1 (0.51) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL3622805 0.83 MEN1 (0.51) MEN1KMT2ANPSR1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110577515-B Synthesis method of 4- (azetidin-3-yl) -1-methylpiperazine-2-one dihydrochloride 南通大学 2022-05-17 — — CN claimed
CN-110577515-A Synthesis method of 4- (azetidin-3-yl) -1-methylpiperazine-2-one dihydrochloride 南通大学 2019-12-17 — — CN claimed
CN-116635371-A Polycyclic pyridazinone derivative serving as SOS1 inhibitor, and preparation method and application thereof 苏州阿尔脉生物科技有限公司 2023-08-22 — — CN disclosed
WO-2022170952-A1 POLYCYCLIC PYRIDAZINONE DERIVATIVE SERVING AS SOS1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州阿尔脉生物科技有限公司 2022-08-18 — — WO disclosed
CN-110577515-B Synthesis method of 4- (azetidin-3-yl) -1-methylpiperazine-2-one dihydrochloride 南通大学 2022-05-17 — — CN disclosed
CN-110577515-B Synthesis method of 4- (azetidin-3-yl) -1-methylpiperazine-2-one dihydrochloride 南通大学 2022-05-17 — — CN disclosed
CN-110577515-A Synthesis method of 4- (azetidin-3-yl) -1-methylpiperazine-2-one dihydrochloride 南通大学 2019-12-17 — — CN disclosed
CN-110577515-A Synthesis method of 4- (azetidin-3-yl) -1-methylpiperazine-2-one dihydrochloride 南通大学 2019-12-17 — — CN disclosed
EP-2766346-B1 SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS AS FACTOR XIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-03-29 — — EP disclosed
US-9416144-B2 Benzoxazine oxazolidinone compound, preparation method and application thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2016-08-16 — — US disclosed
US-20150336984-A1 BENZOXAZINE OXAZOLIDINONE COMPOUND, PREPARATION METHOD AND APPLICATION THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2015-11-26 — — US disclosed
CN-101084208-A Aromatic amides as inhibitors of c-fms kinase JANSSEN PHARMACEUTICA NV (BE) 2007-12-05 — — CN disclosed
US-20070225372-A1 Amides as Bace Inhibitors ELI LILLY AND COMPANY 2007-09-27 — — US disclosed
EP-1807407-A1 AROMATIC AMIDES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-18 — — EP disclosed
US-7189715-B2 Compositions comprising zopiclone derivatives and methods of making and using the same SEPRACOR INC. (US) 2007-03-13 — — US disclosed
US-20070049590-A1 Compositions comprising zopiclone derivatives and methods of making and using the same ALTER DOMUS (US) LLC 2007-03-01 — — US disclosed
EP-1740573-A1 AMIDES AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2007-01-10 — — EP disclosed
US-20060100201-A1 Inhibitors of c-fms kinase JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-11 — — US disclosed
WO-2006047504-A1 AROMATIC AMIDES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-04 — — WO disclosed
WO-2005108391-A1 AMIDES AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2005-11-17 — — WO 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 (4 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-20070225372-A1 Amides as Bace Inhibitors BACE2, BACE1, APP MEN1 1958/4885KMT2A 619/4885NPSR1 904/4885
US-20060100201-A1 Inhibitors of c-fms kinase MUSK, FLT3, FES MEN1 731/4885KMT2A 911/4885NPSR1 329/4885
US-20150336984-A1 BENZOXAZINE OXAZOLIDINONE COMPOUND, PREPARATION METHOD AND APPLICATION THEREOF OXA1L, XDH, MYD88 MEN1 3077/4885KMT2A 4024/4885NPSR1 3556/4885
US-20070049590-A1 Compositions comprising zopiclone derivatives and methods of making and using the same CYP51A1, CYP3A43, HSD17B7 MEN1 1325/4885KMT2A 4273/4885NPSR1 523/4885

“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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