SCHEMBL9577157

SCHEMBL9577157

CCCCc1ccc(-c2nc(-c3c(F)cccc3Cl)nn2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.46
NR1H3 Q13133 3/20 0.41
NR1H2 P55055 2/20 0.41
NPC1 O15118 2/20 0.38
RAB9A P51151 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
HSD17B2 P37059 1/20 0.37
CTRC Q99895 1/20 0.36
UCHL3 P15374 2/20 0.35
PDE2A O00408 1/20 0.35
PDE10A Q9Y233 1/20 0.35
EIF4A1 P60842 1/20 0.35
CRHR1 P34998 1/20 0.34
TP53 P04637 1/20 0.34
GCGR P47871 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL9026017 0.96 HSD11B1 (0.49) HSD11B1NR1H3NR1H2NPC1RAB9A
SCHEMBL8875632 0.86 HSD11B1 (0.39) HSD11B1ADORA3PDE2ACRHR1
SCHEMBL8942480 0.85 NR1H2 (0.44) NR1H3NR1H2NPC1RAB9AHSD17B2
SCHEMBL8942539 0.85 NR1H2 (0.44) NR1H3NR1H2NPC1RAB9AHSD17B2
SCHEMBL8942725 0.83 NR1H2 (0.49) NR1H3NR1H2NPC1RAB9AHSD17B2
SCHEMBL8875250 0.82 HSD11B1 (0.42) HSD11B1CRHR1KMT2A
SCHEMBL8874472 0.82 HSD11B1 (0.40) HSD11B1CRHR1GCGRKMT2A
SCHEMBL8877431 0.82 HSD11B1 (0.40) HSD11B1CRHR1GCGRKMT2A
SCHEMBL8942970 0.81 HSD17B2 (0.50) NR1H3NR1H2NPC1RAB9AHSD17B2
SCHEMBL8874361 0.79 RORC (0.38) NR1H3NR1H2HSD17B2TP53

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
JP-5310712-A None JP disclosed
JP-H05310712-A DIPHENYLTRIAZOLE DERITATIVE AND INSECTICIDAL AND MITICIDAL AGENT KUMIAI CHEM IND CO LTD 1993-11-22 JP disclosed