SCHEMBL7979037

SCHEMBL7979037

Cc1cc(C)c(-c2csc3c(Cl)cc(C)nc23)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.36
RAPGEF4 Q8WZA2 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.33
BDKRB2 P30411 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
NR4A2 P43354 1/20 0.30

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
SCHEMBL13766169 0.85 CRHR1 (0.39) CRHR1MAPTLMNAKDM4EPKM
SCHEMBL14388994 0.78 CRHR1 (0.40) CRHR1RAPGEF4MAPTL3MBTL1LMNA
SCHEMBL7978901 0.75 CRHR1 (0.60) CRHR1
SCHEMBL14388961 0.73 NQO2 (0.33)
SCHEMBL5788960 0.73 CRHR1 (0.48) CRHR1
SCHEMBL5787141 0.73 CRHR1 (0.49) CRHR1
SCHEMBL6025654 0.71 CRHR1 (0.61) CRHR1MAPTL3MBTL1LMNAKDM4E
SCHEMBL28704856 0.69 EIF4EBP1 (0.41)
SCHEMBL14388998 0.69 CRHR1 (0.57) CRHR1
SCHEMBL3902018 0.68 CRHR1 (0.34) CRHR1MAPTLMNAKDM4E

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
US-6211195-B1 NERVOUS SYSTEM, PSYCHOLOGICAL AND GLANDULAR DISORDERS NEUROCRINE BIOSCIENCES, INC. 2001-04-03 US disclosed