SCHEMBL10149008

SCHEMBL10149008

CCOCc1ccn2ccc(C#N)c2c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL10123594 0.82 CYP2A6 (0.38) MAPTTDP1KDM4EALDH1A1HPGD
SCHEMBL343188 0.76 CSNK2A1 (0.34)
SCHEMBL343474 0.70 CA12 (0.44) MAPTTDP1KDM4EALDH1A1HPGD
SCHEMBL10123575 0.70 MAOA (0.35) KDM4EALDH1A1HPGD
SCHEMBL344208 0.69 KDM4E (0.43) MAPTTDP1KDM4EALDH1A1HPGD
SCHEMBL4697051 0.69 ALDH1A1 (0.51) KDM4EALDH1A1
SCHEMBL10123651 0.68 CDC7 (0.33) KDM4EALDH1A1
SCHEMBL10123635 0.67 GABRA1 (0.37)
SCHEMBL10123639 0.66 KIF11 (0.35) MAPTTDP1KDM4EALDH1A1HPGD
SCHEMBL13601191 0.66 MRGPRX4 (0.50)

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-2415771-A1 INDOLIZINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Kissei Pharmaceutical Co., Ltd. (JP) 2012-02-08 EP disclosed