SCHEMBL10355386

SCHEMBL10355386

CCOc1nc(C)[nH]c1-c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ CCNB2 O95067 2/20 0.41
▸ CDK1 P06493 2/20 0.41
▸ CCNB1 P14635 2/20 0.41
▸ GSK3A P49840 2/20 0.41
▸ GSK3B P49841 2/20 0.41
▸ CCNB3 Q8WWL7 2/20 0.41
▸ CDK5 Q00535 1/20 0.41
▸ CDK5R1 Q15078 1/20 0.41
▸ GCGR P47871 2/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MDM2 Q00987 1/20 0.40
▸ TARBP2 Q15633 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38

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
SCHEMBL10355266 0.79 SLC2A1 (0.42) ALDH1A1KDM4EHPGDCCNB2CDK1
Hydrochloric Acid SCHEMBL10355348 0.78 SLC2A1 (0.41) ALDH1A1KDM4EHPGDCCNB2CDK1
SCHEMBL10999375 0.76 MAPK13 (0.48) ALDH1A1KDM4EHPGDGCGRMAPK14
SCHEMBL10355416 0.75 MAPT (0.42) ALDH1A1KDM4EHPGDGCGRMAPK14
Hydrochloric Acid SCHEMBL10355378 0.74 MAPT (0.41) ALDH1A1KDM4EHPGDGCGRMAPK14
SCHEMBL10355369 0.74 DHPS (0.48) ALDH1A1KDM4EHPGDGCGRMAPK14
SCHEMBL7041734 0.73 KDM4E (0.67) KDM4EHPGDCCNB2CDK1CCNB1
SCHEMBL10355417 0.73 CYP1A2 (0.54) ALDH1A1KDM4EHPGDCCNB2CDK1
Hydrochloric Acid SCHEMBL10355415 0.73 DHPS (0.47) ALDH1A1KDM4EHPGDGCGRMAPK14
Hydrochloric Acid SCHEMBL10355308 0.72 CYP1A2 (0.53) ALDH1A1KDM4EHPGDCCNB2CDK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0074130-B1 NEW IMIDAZOLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZAMBON S.p.A. (IT) 1990-09-19 — — EP claimed
US-4560696-A Analgesic, antipyretic or anti-inflammatory imidazole compounds ZAMBON S.P.A. (IT) 1985-12-24 — — US claimed
EP-0074130-A2 New imidazole compounds, process for the preparation thereof and pharmaceutical compositions containing them ZAMBON S.p.A. (IT) 1983-03-16 — — EP claimed
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