SCHEMBL9372014

SCHEMBL9372014

COc1cc2c(cc1OC)-c1cc(OC)c(OC)cc1C2=Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.44
CXCL12 P48061 1/20 0.42
RET P07949 1/20 0.42
ESRRA P11474 3/20 0.41
NQO2 P16083 1/20 0.41
CYP3A4 P08684 1/20 0.40
MAPT P10636 3/20 0.40
HTT P42858 3/20 0.40
LMNA P02545 2/20 0.40
PTGS1 P23219 1/20 0.40
HPGD P15428 1/20 0.40
FOXM1 Q08050 1/20 0.40
RXRA P19793 1/20 0.40
MEN1 O00255 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7981201 0.80 LMNA (0.57) NFE2L2RETNQO2MAPTHTT
SCHEMBL7983283 0.78 NQO2 (0.54) NQO2PTGS1RXRA
SCHEMBL29153453 0.74 MAOB (0.68)
SCHEMBL29153451 0.74 MAOB (0.68)
SCHEMBL9372017 0.72 TNF (0.46) NFE2L2MAPTLMNAMEN1MAPK1
SCHEMBL3294513 0.72 AKR1C3 (0.56)
SCHEMBL9367254 0.71 KDM4E (0.44) NFE2L2CYP3A4MAPTMEN1ALOX15
SCHEMBL10451549 0.69 MEN1 (0.53) NQO2CYP3A4MAPTLMNAHPGD
SCHEMBL27769528 0.67 MMP1 (0.47) NFE2L2CXCL12NQO2MAPTHPGD
SCHEMBL26936527 0.67 TTR (0.67) CXCL12ESRRACYP3A4MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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