SCHEMBL9977620

SCHEMBL9977620

COc1ccc(C2=C(C3=C(c4cc(-c5ccc(OC)cc5)sc4-c4ccc(OC)cc4)C(F)(F)C(F)(F)C3(F)F)CC(c3ccc(OC)cc3)S2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.33
KIT P10721 1/20 0.33
APP P05067 1/20 0.31
TP53 P04637 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
HSD17B10 Q99714 1/20 0.31
OPRD1 P41143 1/20 0.31
MEN1 O00255 1/20 0.31
ALOX12 P18054 1/20 0.31

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
SCHEMBL9965654 0.87 MAPT (0.32) PDGFRBKITTP53SMN1; SMN2MAPT
SCHEMBL9965662 0.85 HSD17B1 (0.33)
SCHEMBL10002013 0.82 APP (0.45) PDGFRBKITAPPTP53RAB9A
SCHEMBL13000069 0.82 BCHE (0.32) SMN1; SMN2
SCHEMBL16011190 0.77 APP (0.40) PDGFRBKITAPPTP53RAB9A
SCHEMBL16011184 0.76 THRB (0.38) APPSMN1; SMN2MAPTALOX15OPRD1
SCHEMBL21291329 0.76 THRB (0.38) APPSMN1; SMN2MAPTALOX15OPRD1
SCHEMBL14838429 0.76 THRB (0.38) APPSMN1; SMN2MAPTALOX15OPRD1
SCHEMBL16024128 0.76 THRB (0.38) APPSMN1; SMN2MAPTALOX15OPRD1
SCHEMBL14838376 0.76 THRB (0.38) APPSMN1; SMN2MAPTALOX15OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012079160-A1 VARIABLE TRANSMITTANCE OPTICAL FILTER WITH SUBSTANTIALLY CO- PLANAR ELECTRODE SYSTEM SWITCH MATERIALS, INC. (CA) 2012-06-21 WO disclosed