SCHEMBL2736670

SCHEMBL2736670

CCOC(=O)c1ccc(-n2cc(N)c3ccc(OCc4ccc(Cl)cc4)cc32)cc1OCOC

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.41
MAOB P27338 6/20 0.40
MAOA P21397 3/20 0.40
TP53 P04637 1/20 0.39
ACHE P22303 1/20 0.38
SLC26A4 O43511 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL10207829 0.89 ALDH1A1 (0.42)
SCHEMBL12309578 0.88
SCHEMBL2736677 0.87 SMN1; SMN2 (0.43) MAOBMAOASLC26A4KMT2A
SCHEMBL2736960 0.86 GABRA1 (0.41)
SCHEMBL10208272 0.86 POLB (0.39)
SCHEMBL2736994 0.85 POLB (0.38)
SCHEMBL10207673 0.85 PSEN1 (0.38) TP53KMT2AMAPK1
SCHEMBL2736652 0.85 MAPT (0.37) TP53KMT2A
SCHEMBL2736633 0.84 KDM4E (0.39) KMT2A
SCHEMBL10207266 0.84 POLB (0.37)

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
EP-2402314-A1 (Aza)indole derivative and use thereof for medical purposes Kissei Pharmaceutical Co., Ltd. (JP) 2012-01-04 EP disclosed