SCHEMBL2736782

SCHEMBL2736782

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

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.42
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NEK2 P51955 1/20 0.37
PLK1 P53350 1/20 0.37
MAPK14 Q16539 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
SCHEMBL10208272 0.91 POLB (0.39) POLBGAA
SCHEMBL2736960 0.91 GABRA1 (0.41) POLBGAA
SCHEMBL10207829 0.90 ALDH1A1 (0.42) POLBGAA
SCHEMBL2736994 0.89 POLB (0.38) POLBGAA
SCHEMBL2736633 0.88 KDM4E (0.39) HPGDMEN1KMT2A
SCHEMBL10207266 0.88 POLB (0.37) POLBGAA
SCHEMBL12309584 0.88
SCHEMBL10207673 0.85 PSEN1 (0.38) HPGDGAAMEN1KMT2A
SCHEMBL2736652 0.85 MAPT (0.37) HPGDPOLBMEN1KMT2A
SCHEMBL2737079 0.84

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