SCHEMBL990939

SCHEMBL990939

O=C(Cl)c1ccc(OCCN2CCOCC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
KDM4E B2RXH2 4/20 0.70
ALDH1A1 P00352 3/20 0.70
HRH3 Q9Y5N1 4/20 0.60
THRB P10828 2/20 0.60
LMNA P02545 1/20 0.60
MAPT P10636 1/20 0.60
KMT2A Q03164 1/20 0.60
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA7 P43166 1/20 0.59
CA9 Q16790 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
PSMB1 P20618 2/20 0.57
PSMB5 P28074 2/20 0.57
THRA P10827 1/20 0.57
PSMB2 P49721 1/20 0.57

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
Hydrochloric Acid SCHEMBL20575398 0.99 GAA (0.70) GAASMN1; SMN2KDM4EALDH1A1HRH3
SCHEMBL1244065 0.93 HRH3 (0.69) GAASMN1; SMN2KDM4EALDH1A1HRH3
SCHEMBL991354 0.87 ALDH1A1 (0.76) GAASMN1; SMN2KDM4EALDH1A1HRH3
SCHEMBL5685572 0.87 PSMB1 (0.75) KDM4EHRH3PSMB1PSMB5PSMB2
SCHEMBL3646371 0.86 KDM4E (0.58) GAASMN1; SMN2KDM4EALDH1A1NPC1
SCHEMBL4455251 0.86 ALDH1A1 (0.92) GAASMN1; SMN2KDM4EALDH1A1HRH3
Hydrochloric Acid SCHEMBL7887532 0.86 ALDH1A1 (0.74) GAASMN1; SMN2KDM4EALDH1A1HRH3
SCHEMBL3007594 0.86 GAA (0.71) GAASMN1; SMN2KDM4EALDH1A1HRH3
Hydrochloric Acid SCHEMBL6174512 0.85 PSMB1 (0.73) SMN1; SMN2KDM4EALDH1A1HRH3THRB
SCHEMBL1358423 0.85 PSMB1 (0.78) KDM4EALDH1A1HRH3THRBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025914-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS LTD (GB) 2024-01-25 US disclosed
US-20240025914-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS LTD (GB) 2024-01-25 US disclosed
US-20230002394-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS, LTD. (GB) 2023-01-05 US disclosed
CN-115160257-A Synthetic preparation method of curcumin derivative 河南省锐达医药科技有限公司 2022-10-11 CN disclosed
US-20210214362-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS, LTD. (GB) 2021-07-15 US disclosed
US-20210139490-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS LTD (GB) 2021-05-13 US disclosed
EP-3237419-B1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS LTD (GB) 2021-02-17 EP disclosed
CN-111253339-B Synthetic preparation method of curcumin derivatives and application of curcumin derivatives in cancer treatment 河南省锐达医药科技有限公司 2021-01-26 CN disclosed
US-20200407364-A1 FUSED BICYCLIC COMPOUNDS AKARNA THERAPEUTICS LTD (GB) 2020-12-31 US disclosed
US-20200325140-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE AKARNA THERAPEUTICS, LTD. (CH) 2020-10-15 US disclosed
US-20080132459-A1 Inhibitors of Histone Deacetylase METHYLGENE, INC. (CA) 2008-06-05 US disclosed
US-20080132459-A1 Inhibitors of Histone Deacetylase METHYLGENE, INC. (CA) 2008-06-05 US disclosed
US-20080132459-A1 Inhibitors of Histone Deacetylase METHYLGENE, INC. (CA) 2008-06-05 US disclosed
EP-1663953-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2006-06-07 EP disclosed
WO-2005030705-A9 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC (CA) 2006-04-20 WO disclosed
WO-2005030704-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2005-04-07 WO disclosed
WO-2005030704-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2005-04-07 WO disclosed
WO-2005030705-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2005-04-07 WO disclosed
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP 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 (7 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-20200325140-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, BRDT, PAICS GAA 199/4885SMN1; SMN2 61/4885KDM4E 3393/4885
US-20080132459-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 GAA 210/4885SMN1; SMN2 3671/4885KDM4E 123/4885
US-20230002394-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, BRDT, PAICS GAA 199/4885SMN1; SMN2 61/4885KDM4E 3393/4885
US-20210139490-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, BRDT, PAICS GAA 199/4885SMN1; SMN2 61/4885KDM4E 3393/4885
US-20200407364-A1 FUSED BICYCLIC COMPOUNDS BICRA, PAICS, NDC1 GAA 3157/4885SMN1; SMN2 1918/4885KDM4E 3546/4885
US-20210214362-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, BRDT, PAICS GAA 199/4885SMN1; SMN2 61/4885KDM4E 3393/4885
US-20240025914-A1 FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, BRDT, PAICS GAA 199/4885SMN1; SMN2 61/4885KDM4E 3393/4885

“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.