SCHEMBL693705

SCHEMBL693705

Cc1sccc1-c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.42
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
TAAR1 Q96RJ0 2/20 0.40
ESR2 Q92731 1/20 0.40
HSD17B1 P14061 1/20 0.39
HSD17B2 P37059 1/20 0.39
PGR P06401 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
TNKS2 Q9H2K2 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
CDC7 O00311 1/20 0.36
ROCK2 O75116 1/20 0.36

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
SCHEMBL8084175 0.81 HSD17B10 (0.44) ACHEMEN1MAPTKMT2ACHRNB4
SCHEMBL28763604 0.79 TAAR1 (0.50) KDM4EMEN1MAPTKMT2ATAAR1
SCHEMBL30172706 0.78 KDM4E (0.41) KDM4EMEN1MAPTKMT2ATAAR1
SCHEMBL22261519 0.78 KDM4E (0.41) KDM4EMEN1MAPTKMT2ATAAR1
SCHEMBL695291 0.76 PTGS1 (0.51) ACHE
SCHEMBL1825367 0.76 BCAT2 (0.47) MEN1KMT2AESR2HSD17B10
SCHEMBL9009002 0.75 HSD17B1 (0.44) ESR2HSD17B1HSD17B2GAA
SCHEMBL694184 0.74 CYP2A6 (0.53) ACHEKDM4EMEN1MAPTKMT2A
SCHEMBL24508433 0.74 PTGS1 (0.40) KDM4EMEN1MAPTKMT2ATAAR1
SCHEMBL24508434 0.73 BCAT2 (0.50) KDM4EMEN1MAPTKMT2APIM1

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
EP-2421825-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
WO-2010124108-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed