SCHEMBL4619988

SCHEMBL4619988

O=C1C=CC=C2c3ccccc3OC12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.37
ADORA3 P0DMS8 3/20 0.37
MAOB P27338 3/20 0.37
AR P10275 2/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
PARP1 P09874 1/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 2/20 0.33
HSD11B1 P28845 1/20 0.33
AKR1C3 P42330 1/20 0.33
RET P07949 1/20 0.33
KDR P35968 1/20 0.33
NPC1 O15118 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL6049871 0.90 CYP19A1 (0.38) CYP19A1ADORA3MAOBARKDM4E
SCHEMBL8663560 0.79 KDM4E (0.30) CYP19A1ADORA3MAOBARKDM4E
SCHEMBL4621136 0.76 RET (0.31) RETKDR
SCHEMBL6662779 0.74 CYP19A1 (0.36) CYP19A1ADORA3MAOBARKDM4E
SCHEMBL7101024 0.73 TDP1 (0.32) KDM4EMEN1KMT2AKDRMAPK1
SCHEMBL9856224 0.72 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL9298066 0.70 KDM4E (0.30) KDM4E
SCHEMBL600651 0.67 KDM4E (0.33) CYP19A1ADORA3MAOBARKDM4E
SCHEMBL6688204 0.66 MAPT (0.45) KDM4EMAPTMEN1KMT2APOLB
SCHEMBL18371749 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885709-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES Pharmos Corporation (US) 2008-02-13 EP claimed
WO-2006129318-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES PHARMOS CORPORATION (US) 2006-12-07 WO claimed
EP-1885709-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES Pharmos Corporation (US) 2008-02-13 EP disclosed
WO-2006129318-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES PHARMOS CORPORATION (US) 2006-12-07 WO disclosed