SCHEMBL7974225

SCHEMBL7974225

CON(C)C(=O)/C=C/c1c[nH]c(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.36
NR4A2 P43354 1/20 0.34
EPHX2 P34913 1/20 0.33
TRPM8 Q7Z2W7 2/20 0.32
MAP3K7 O43318 2/20 0.32
TAB1 Q15750 2/20 0.32
LMNA P02545 2/20 0.32
KCNN4 O15554 1/20 0.31
ALOX5 P09917 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
NPC1 O15118 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 2/20 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
SCHEMBL7405031 0.85 MAP3K7 (0.44) APPMAP3K7TAB1LMNAKCNN4
SCHEMBL7974226 0.83 KDM4E (0.44) NR4A2MAP3K7TAB1LMNANPC1
SCHEMBL18065068 0.79 TRPM8 (0.36) TRPM8KCNN4
SCHEMBL8490705 0.73 TRPA1 (0.38) LMNAALOX5NPC1
SCHEMBL7978927 0.73 AKR1C3 (0.42) NR4A2
SCHEMBL8487037 0.72
SCHEMBL7962818 0.71 EPHX2 (0.38) APPEPHX2
SCHEMBL6821626 0.70 RECQL (0.50) LMNANPC1
SCHEMBL1830315 0.70 KCNN4 (0.40) NR4A2LMNAKCNN4NPC1KDM4E
SCHEMBL7789115 0.69 SIRT2 (0.42) APPEPHX2NPC1L3MBTL1

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-2001081317-A1 CHIRAL IMIDAZOYL INTERMEDIATES FOR THE SYNTHESIS OF 2-(4-IMIDAZOYL)-CYCLOPROPYL DERIVATIVES GLIATECH, INC. (US) 2001-11-01 WO disclosed