SCHEMBL10035902

SCHEMBL10035902

COc1ccc(Cc2sc(-c3ccc(OC)cc3)cc2C2=C(c3cc(-c4ccc(OC)cc4)sc3-c3ccc(OC)cc3)C(F)(F)C(F)(F)C2(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.37
APP P05067 4/20 0.35
OPRD1 P41143 1/20 0.34
IKBKB O14920 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
CHEK1 O14757 1/20 0.32
ALDH1A1 P00352 4/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 3/20 0.32
NPC1 O15118 2/20 0.32
TP53 P04637 2/20 0.32
RAB9A P51151 2/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 2/20 0.32
PDGFRB P09619 1/20 0.32
KIT P10721 1/20 0.32
MEN1 O00255 1/20 0.32
CASP3 P42574 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL14838430 0.92 MAOA (0.35) ALOX5ALDH1A1MAPTMEN1KMT2A
SCHEMBL21695434 0.90 ALOX5 (0.40) ALOX5APPTP53ALOX15TSHR
SCHEMBL10002013 0.88 APP (0.45) APPOPRD1IKBKBESR1ESR2
SCHEMBL16021760 0.86 OPRD1 (0.41) ALOX5APPOPRD1IKBKBESR1
SCHEMBL9965558 0.84 EP300 (0.33) ESR1ESR2
SCHEMBL10036359 0.82 HSD17B1 (0.38) ESR1ESR2ALDH1A1MAPTMEN1
SCHEMBL16011190 0.82 APP (0.40) ALOX5APPOPRD1IKBKBESR1
SCHEMBL14838514 0.81 OPRD1 (0.39) APPOPRD1IKBKBESR1ESR2
SCHEMBL9965654 0.80 MAPT (0.32) MAPTTP53PDGFRBKITSMN1; SMN2
SCHEMBL16024128 0.80 THRB (0.38) APPOPRD1IKBKBESR1ESR2

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
US-20120044560-A9 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2012-02-23 US disclosed
US-20100315693-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER AND USES THEREOF SWITCH MATERIALS, INC. (CA) 2010-12-16 US disclosed