SCHEMBL7980288

SCHEMBL7980288

COc1cc2c(cc1OC)C(Cc1ccccc1)c1c-2ccc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.47
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4C Q9H3R0 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CYP3A4 P08684 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
ABCB1 P08183 1/20 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
SCHEMBL7970093 0.86 KCNH2 (0.42) KCNH2MAPTALDH1A1HSD17B10KDM4C
SCHEMBL7984054 0.84 KDM4E (0.45) MAPTALDH1A1HSD17B10KDM4CSIRT2
SCHEMBL9372932 0.71 TUBB4A (0.47) MAPTALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL7983584 0.70 PDE4D (0.47) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL7983806 0.65 PDE10A (0.40) MAPTALDH1A1HSD17B10SMN1; SMN2LMNA
SCHEMBL7987634 0.64 ADRB2 (0.39) KCNH2ALOX15
SCHEMBL1818592 0.63 RAB9A (0.43) MAPTALDH1A1HSD17B10SMN1; SMN2LMNA
SCHEMBL30514359 0.63 CA2 (0.53) MAPTALDH1A1SMN1; SMN2LMNAKMT2A
Hydrochloric Acid SCHEMBL1819160 0.62 NPC1 (0.42) MAPTALDH1A1HSD17B10SMN1; SMN2LMNA
Fluoride Ion SCHEMBL1819483 0.62 NPC1 (0.42) MAPTALDH1A1HSD17B10SMN1; SMN2LMNA

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