SCHEMBL13929502

SCHEMBL13929502

Cc1c(C#N)c(NCCO)nc(NCCO)c1/N=N/c1ncn(-c2ncccn2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 2/20 0.41
▸ CDK2 P24941 2/20 0.41
▸ CCNA1 P78396 2/20 0.41
▸ EGFR P00533 1/20 0.38
▸ KDM4E B2RXH2 9/20 0.36
▸ ALDH1A1 P00352 6/20 0.36
▸ HPGD P15428 2/20 0.36
▸ MAPT P10636 4/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ GLA P06280 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ AURKA O14965 1/20 0.34
▸ ADORA1 P30542 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL13929530 0.87 KDM4E (0.35) KDM4EALDH1A1HPGDGAAAURKA
SCHEMBL13929531 0.84 MEN1 (0.30) MEN1KMT2A
SCHEMBL13929081 0.82 ALDH1A1 (0.38) CCNA2CDK2CCNA1EGFRKDM4E
SCHEMBL13929082 0.75 ALDH1A1 (0.32) KDM4EALDH1A1HPGDMAPTMEN1
SCHEMBL13925671 0.72 CCNA2 (0.41) CCNA2CDK2CCNA1EGFRKDM4E
SCHEMBL13929503 0.71 MAPT (0.38) KDM4EALDH1A1HPGDMAPTMEN1
SCHEMBL10119019 0.70 CCNA2 (0.44) CCNA2CDK2CCNA1EGFRKDM4E
SCHEMBL15170343 0.70 CCNA2 (0.44) CCNA2CDK2CCNA1EGFRKDM4E
SCHEMBL13929478 0.69 CDK1 (0.32) —
SCHEMBL13925388 0.68 CCNA2 (0.36) CCNA2CDK2CCNA1EGFRKDM4E

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-2039726-A2 Azo pigment and pigment dispersion FUJIFILM Corporation (JP) 2009-03-25 — — EP disclosed
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