SCHEMBL2736677

SCHEMBL2736677

CCOC(=O)c1ccc(-n2cc(N)c3ccc(OCc4ccccc4Cl)cc32)cc1OCOC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 2/20 0.43
THRB P10828 1/20 0.43
MEN1 O00255 1/20 0.39
SLC26A4 O43511 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CMA1 P23946 1/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL12309575 0.88
SCHEMBL10207829 0.87 ALDH1A1 (0.42) SMN1; SMN2MAPTALDH1A1
SCHEMBL2736670 0.87 MCHR1 (0.41) SLC26A4KMT2AMAOAMAOB
SCHEMBL2736633 0.86 KDM4E (0.39) SMN1; SMN2MEN1KMT2AALDH1A1RAB9A
SCHEMBL2736960 0.85 GABRA1 (0.41)
SCHEMBL10208272 0.85 POLB (0.39)
SCHEMBL10207673 0.83 PSEN1 (0.38) SMN1; SMN2MAPTMEN1KMT2AALDH1A1
SCHEMBL2736994 0.83 POLB (0.38)
SCHEMBL2736652 0.83 MAPT (0.37) SMN1; SMN2MAPTMEN1KMT2AALDH1A1
SCHEMBL10207266 0.83 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