SCHEMBL15028231

SCHEMBL15028231

N#Cc1ccc(N2c3ccc(Br)cc3Oc3cc(Br)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.40
ELANE P08246 1/20 0.39
POLB P06746 1/20 0.39
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
HSD17B3 P37058 1/20 0.36
TDP2 O95551 1/20 0.34
PGR P06401 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
USP2 O75604 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 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
SCHEMBL23660862 0.85 AHR (0.50) AHRPGRFAAHMGLLTP53
SCHEMBL29534796 0.85 AHR (0.50) AHRPGRFAAHMGLLTP53
SCHEMBL22509259 0.79 POLB (0.43) ELANEPOLBMAOBMAOATDP2
SCHEMBL13328077 0.79 AHR (0.44) AHRELANEHSD17B3MGLLKDM4E
SCHEMBL12195289 0.78 AHR (0.52) AHRPOLBMAOAPGRMGLL
SCHEMBL19344969 0.77 ELANE (0.42) ELANEPOLBPGR
SCHEMBL28335893 0.77 DDAH1 (0.41) ELANEPOLBPGR
SCHEMBL13133441 0.76 AHR (0.41) AHRFAAHMGLL
SCHEMBL12440940 0.76 AHR (0.41) AHRELANEMAOBHSD17B3MGLL
SCHEMBL18545086 0.76 AHR (0.46) AHRPGRFAAHMGLLTP53

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-2013085285-A1 CO-ABSORBENT FOR DYE-SENSITIZED SOLAR CELL HAVING HOLE CONDUCTION PROPERTIES AND DYE-SENSITIZED SOLAR CELL INCLUDING SAME 고려대학교 산학협력단 (KR) 2013-06-13 WO disclosed