SCHEMBL5596701

SCHEMBL5596701

COc1ccc(COc2n[c]ccn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 0.50
MAOB P27338 3/20 0.49
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
IDO1 P14902 2/20 0.43
AGXT P21549 2/20 0.43
FFAR1 O14842 1/20 0.43

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
SCHEMBL5596509 0.85 TAAR1 (0.41) APPMAOBALDH1A1HTTSMN1; SMN2
SCHEMBL4965891 0.80 ALDH1A1 (0.52) NPC1RAB9AALDH1A1MAPTHTT
SCHEMBL5596953 0.80 MGMT (0.38) MAOBHTTSMN1; SMN2
SCHEMBL5596934 0.80 LMNA (0.43) MAOBRAB9AMAPTSMN1; SMN2
SCHEMBL31080534 0.80 NPC1 (0.61) APPMAOBNPC1RAB9AMAPT
SCHEMBL14958421 0.76 APP (0.58) APPMAOBNPC1RAB9AALDH1A1
SCHEMBL20000873 0.75 APP (0.80) APPMAOBNPC1RAB9AALDH1A1
SCHEMBL9480094 0.75 APP (0.50) APPMAOBNPC1RAB9AALDH1A1
SCHEMBL5619630 0.74 LMNA (0.49) MAOBNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL5597096 0.74 NPC1 (0.50) MAOBNPC1RAB9AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1696909-B1 BENZOTHIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES SERONO LAB (CH) 2007-11-14 EP claimed
EP-1450792-B1 BENZAZOLE DERIVATIVES FOR THE TREATMENT OF SCLERODERMA APPLIED RESEARCH SYSTEMS (AN) 2006-09-27 EP disclosed
EP-1450792-A1 BENZAZOLE DERIVATIVES FOR THE TREATMENT OF SCLERODERMA Applied Research Systems ARS Holding N.V. (AN) 2004-09-01 EP disclosed
EP-1240164-B1 BENZAZOLE DERIVATIVES AND THEIR USE AS JNK MODULATORS APPLIED RESEARCH SYSTEMS (AN) 2003-11-12 EP disclosed
WO-2003047570-A1 BENZAZOLE DERIVATIVES FOR THE TREATMENT OF SCLERODERMA APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2003-06-12 WO disclosed
EP-1240164-A1 BENZAZOLE DERIVATIVES AND THEIR USE AS JNK MODULATORS Applied Research Systems ARS Holding N.V. (AN) 2002-09-18 EP disclosed
WO-2001047920-A1 BENZAZOLE DERIVATIVES AND THEIR USE AS JNK MODULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-07-05 WO disclosed