SCHEMBL4442500

SCHEMBL4442500

CC(=O)c1cccn2c[c]nc12

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.34
MAPK1 P28482 2/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ELANE P08246 1/20 0.31
ENPP3 O14638 1/20 0.30
ALPL P05186 1/20 0.30
XIAP P98170 1/20 0.30

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
SCHEMBL358067 0.73 RAB9A (0.42) MAPK1LMNASMN1; SMN2
SCHEMBL8313115 0.72 HTR2A (0.43) DHODH
SCHEMBL4430653 0.70
SCHEMBL4436785 0.70
SCHEMBL4441709 0.69 PDE10A (0.41)
SCHEMBL4436859 0.69 NR1I2 (0.33)
SCHEMBL15065498 0.69 CA1 (0.37) MAPK1SMN1; SMN2
SCHEMBL4441393 0.66 CA2 (0.37) MAPK1LMNA
SCHEMBL29056314 0.64 IDO1 (0.52) DHODHMAPK1SMN1; SMN2
SCHEMBL31650754 0.64 HTT (0.50) LMNASMN1; SMN2

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-7618981-B2 to treat cellular proliferative diseases, hyperplasias, solid tumor, cardiac hypertrophy, immune disorders and inflammation; modulators of one or more mitotic kinesins; N-(2-(2-dimethylamino-acetylamino)-1-{4-[8-(1-hydroxy-ethyl)-imidazo[1,2-a]pyridin-2-yl]-benzyl}-ethyl)-3-chloro-4-isopropoxy-benzamide CYTOKINETICS, INC. (US) 2009-11-17 US claimed