SCHEMBL17148296

SCHEMBL17148296

Cc1cc(NC(=O)c2[nH]cnc2C(=O)NCCN2CCCCC2)ccc1NC(=O)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ CDK1 P06493 1/20 0.44
▸ CCNB1 P14635 1/20 0.44
▸ CCNA2 P20248 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ MCHR1 Q99705 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ HTR2C P28335 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ CTNNB1 P35222 1/20 0.42
▸ TCF7L2 Q9NQB0 1/20 0.42
▸ SCN9A Q15858 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42

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
SCHEMBL17148171 0.92 CDK1 (0.45) KITSMN1; SMN2KMT2ACDK1CCNB1
SCHEMBL17148246 0.90 KMT2A (0.52) SMN1; SMN2KMT2ARAB9AMAPK1HTT
SCHEMBL17148299 0.90 KMT2A (0.47) SMN1; SMN2KMT2ACDK1CCNB1CCNA2
SCHEMBL17148279 0.88 EPHX2 (0.44) KITKMT2ACDK1CCNB1CCNA2
SCHEMBL17142511 0.86 KMT2A (0.54) SMN1; SMN2KMT2ARAB9AMAPK1HTT
SCHEMBL17143130 0.85 KMT2A (0.55) KITSMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL17148175 0.85 EPHX2 (0.45) KITSMN1; SMN2KMT2AMCHR1HTR2C
SCHEMBL17148343 0.84 TP53 (0.49) KITSMN1; SMN2KMT2AMAPTHTT
SCHEMBL17142945 0.84 KMT2A (0.48) SMN1; SMN2KMT2ACCNA2CDK2RAB9A
SCHEMBL17148201 0.84 KMT2A (0.55) SMN1; SMN2KMT2AMAPTPOLBEPHX2

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
US-9884063-B2 Amido-substituted azole compounds BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-06 — — US disclosed
WO-2015150449-A2 AMIDO-SUBSTITUTED AZOLE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-10-08 — — WO disclosed
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