SCHEMBL16995283

SCHEMBL16995283

Cc1cccc(F)c1C(=O)Nc1c[nH]nc1C(=O)NCCN1C(C)CCCC1C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ BCL3 P20749 1/20 0.38
▸ CDK2 P24941 6/20 0.37
▸ CCNA2 P20248 5/20 0.37
▸ CDK1 P06493 3/20 0.37
▸ CCNB1 P14635 3/20 0.37
▸ CCNA1 P78396 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ L3MBTL1 Q9Y468 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
SCHEMBL8215154 0.94 BCL3 (0.43) PDGFRAHPGDBCL3CDK2CCNA2
SCHEMBL16995287 0.79 CDK2 (0.45) CDK2CCNA2CDK1CCNB1
SCHEMBL16995307 0.77 HTR4 (0.45) BCL3CDK2CCNA2CDK1CCNB1
SCHEMBL8226199 0.75 CCNA2 (0.53) BCL3CDK2CCNA2CDK1CCNB1
SCHEMBL13543788 0.75 CCNA2 (0.48) KMT2ABCL3CDK2CCNA2CDK1
SCHEMBL8219161 0.74 CCNA2 (0.63) MEN1KMT2ACDK2CCNA2CDK1
SCHEMBL16995302 0.74 L3MBTL1 (0.48) MEN1KMT2ACDK2CCNA2CDK1
SCHEMBL8261337 0.74 CCNA2 (0.57) MEN1KMT2ACDK2CCNA2CDK1
SCHEMBL8223960 0.74 BCL3 (0.70) MEN1KMT2ABCL3SMN1; SMN2
SCHEMBL16995312 0.74 L3MBTL1 (0.54) L3MBTL1

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-1845973-B1 PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2015-08-12 — — EP disclosed
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