SCHEMBL8315607

SCHEMBL8315607

COCCCN1CC(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
AHR P35869 2/20 0.38
HTR2C P28335 1/20 0.38
APOBEC3G Q9HC16 1/20 0.37
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GLA P06280 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
CMA1 P23946 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
TSHR P16473 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL8315186 0.85 APOBEC3G (0.42) MAPTKDM4EALDH1A1HTR2CAPOBEC3G
SCHEMBL8316573 0.85 ALDH1A1 (0.38) EPHX2KDM4EALDH1A1SMN1; SMN2KMT2A
SCHEMBL24359573 0.82 EPHX2 (0.56) EPHX2MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL30964312 0.80 MAOB (0.56) MAPTHTR2CKMT2AMEN1PGR
SCHEMBL8314411 0.78 ALDH1A1 (0.38) EPHX2MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL13150265 0.75 CYP11B1 (0.53) EPHX2MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL6540315 0.74 PGR (0.49) PGR
SCHEMBL7173876 0.73 KDM4E (0.42) EPHX2MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL6540849 0.70 KMT2A (0.50) EPHX2MAPTAHRKMT2AMAPK1
SCHEMBL8317748 0.70 ALDH1A1 (0.36) KDM4EALDH1A1APOBEC3GKMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536419-B1 TRICYCLIC TRIAZOLE DERIVATIVES, PRODUCTION AND USE THEREOF TORAY INDUSTRIES (JP) 1999-10-13 EP disclosed
US-5683998-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, ANTIPAF AGENTS TORAY INDUSTRIES, INC. (JP) 1997-11-04 US disclosed
EP-0536419-A1 TRICYCLIC TRIAZOLE DERIVATIVE, PRODUCTION THEREOF, AND USE THEREOF TORAY INDUSTRIES, INC. (JP) 1993-04-14 EP disclosed