SCHEMBL17133607

SCHEMBL17133607

COc1ccc(C=Cc2nc(Cl)nc(Cl)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.56
CYP1A2 P05177 3/20 0.55
KDM4E B2RXH2 3/20 0.55
CYP3A4 P08684 2/20 0.55
NPC1 O15118 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
RELA Q04206 3/20 0.53
TRPA1 O75762 1/20 0.53
CYP1A1 P04798 3/20 0.52
CYP1B1 Q16678 3/20 0.52
ESR1 P03372 2/20 0.52
NFE2L2 Q16236 2/20 0.52
PTGS2 P35354 2/20 0.52
TUBB4A P04350 2/20 0.52
TUBB P07437 2/20 0.52

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
SCHEMBL24897242 0.87 CYP1A2 (0.64) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL4750561 0.84 SMN1; SMN2 (0.46) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL16117347 0.80 RELA (0.60) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL5788349 0.79 AHR (0.53) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL5788351 0.79 AHR (0.53) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL51498 0.78 CYP1A2 (0.50) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL51497 0.78 CYP1A2 (0.50) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL3625409 0.78 CYP1A2 (0.50) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL21940412 0.78 CYP1A2 (0.50) AHRCYP1A2KDM4ECYP3A4NPC1
SCHEMBL3625405 0.78 CYP1A2 (0.50) AHRCYP1A2KDM4ECYP3A4NPC1

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
EP-2927716-A1 CURABLE RESIN COMPOSITION, AND IMAGE-SENSOR-CHIP PRODUCTION METHOD AND IMAGE SENSOR CHIP USING SAME FUJIFILM Corporation (JP) 2015-10-07 EP disclosed