SCHEMBL7970824

SCHEMBL7970824

COc1cc2c(cc1OC)-c1ccc(OC)c(OC)c1C2=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
NPC1 O15118 2/20 0.65
USP8 P40818 1/20 0.49
USP7 Q93009 1/20 0.49
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 6/20 0.47
KMT2A Q03164 5/20 0.47
MAPT P10636 5/20 0.47
MEN1 O00255 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
USP2 O75604 1/20 0.47
DUSP3 P51452 1/20 0.47
HPGD P15428 4/20 0.47
LMNA P02545 4/20 0.47
MAPK1 P28482 3/20 0.47
HTT P42858 3/20 0.47
POLB P06746 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL7786089 0.82 RAB9A (0.87) RAB9ASMN1; SMN2NPC1USP8USP7
SCHEMBL12253692 0.79 RAB9A (0.76) RAB9ASMN1; SMN2NPC1USP8USP7
SCHEMBL496978 0.79 RAB9A (1.00) RAB9ASMN1; SMN2NPC1USP8USP7
SCHEMBL19456389 0.78 NPC1 (0.62) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL30475405 0.77 RAB9A (0.61) RAB9ASMN1; SMN2NPC1USP8USP7
SCHEMBL28872388 0.77 RAB9A (0.61) RAB9ASMN1; SMN2NPC1USP8USP7
SCHEMBL3899483 0.76 CA1 (0.54) USP8USP7ALDH1A1KDM4EKMT2A
SCHEMBL28575367 0.76 CA1 (0.54) USP8USP7ALDH1A1KDM4EKMT2A
SCHEMBL19450184 0.75 NPC1 (0.58) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL28872293 0.74 RAB9A (0.59) RAB9ASMN1; SMN2NPC1USP8USP7

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
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed