SCHEMBL13634290

SCHEMBL13634290

CCC(=O)N1CCC(c2nc(CC)cs2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2A Q9UIF9 1/20 0.41
GPR119 Q8TDV5 2/20 0.41
MAPT P10636 3/20 0.39
LMNA P02545 3/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ENPP2 Q13822 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38
EPHX2 P34913 6/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SLC6A3 Q01959 1/20 0.36
AOC3 Q16853 1/20 0.36
DNM1L O00429 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
SCHEMBL12036182 0.88 BAZ2A (0.49) BAZ2AGPR119MAPTENPP2MEN1
SCHEMBL13162592 0.83 EPHX2 (0.39) BAZ2AMAPTLMNAMAPK1SMN1; SMN2
SCHEMBL12269648 0.81 GPR119 (0.37) BAZ2AGPR119MAPTLMNAMEN1
SCHEMBL13634287 0.80 ERBB2 (0.39) BAZ2AGPR119SMN1; SMN2SLC6A3
SCHEMBL12387815 0.79 SLC6A3 (0.47) BAZ2AGPR119SMN1; SMN2NPC1RAB9A
SCHEMBL2773331 0.79 CASP3 (0.47) BAZ2AMAPTSMN1; SMN2MEN1CYP1A2
SCHEMBL13162298 0.78 BAZ2A (0.38) BAZ2AMAPTLMNAMAPK1SMN1; SMN2
SCHEMBL28230821 0.77 GPR119 (0.53) BAZ2AGPR119MAPT
SCHEMBL13523714 0.77 GAA (0.50) LMNACYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL12036168 0.77 BAZ2A (0.44) BAZ2AGPR119SLC6A3AOC3DNM1L

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-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed