SCHEMBL4452111

SCHEMBL4452111

CCSc1nc(-c2ccncc2)nc(NCCO)c1C(=O)Nc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 1/20 0.42
LATS2 Q9NRM7 1/20 0.42
NAMPT P43490 1/20 0.39
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ROCK2 O75116 1/20 0.37
APEX1 P27695 1/20 0.37
RAB9A P51151 2/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL1704061 0.90 LATS1 (0.43) LATS1LATS2NAMPTCDK1CCNB1
SCHEMBL4635385 0.84 MEN1 (0.40) LATS1LATS2NAMPTCDK1CCNB1
SCHEMBL1705388 0.83 RAB9A (0.43) LATS1LATS2MEN1KMT2AALDH1A1
SCHEMBL1704731 0.82 CYP3A4 (0.43) LATS1LATS2NAMPTMEN1KMT2A
SCHEMBL1704446 0.82 MAPK1 (0.44) LATS1LATS2NAMPTMEN1KMT2A
SCHEMBL2953212 0.82 LATS1 (0.43) LATS1LATS2MEN1KMT2AALDH1A1
SCHEMBL2956022 0.80 MEN1 (0.46) LATS1LATS2NAMPTMEN1KMT2A
SCHEMBL2952980 0.78 CCNC (0.42) LATS1LATS2NAMPTMEN1KMT2A
SCHEMBL2950038 0.77 KMT2A (0.46) NAMPTCDK1CCNB1CCNA2CDK2
SCHEMBL2956044 0.76 LATS1 (0.48) LATS1LATS2NAMPTCDK1CCNB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2109690-A1 NOVEL TISSUE PROTECTIVE ERYTHROPOIETIN RECEPTOR (NEPOR) AND METHODS OF USE Alepor GMBH & CO. KG (DE) 2009-10-21 EP disclosed
WO-2009068677-A1 NOVEL TISSUE PROTECTIVE ERYTHROPOIETIN RECEPTOR (NEPOR) AND METHODS OF USE ALEPOR GMBH & CO. KG (DE) 2009-06-04 WO disclosed