SCHEMBL26977284

SCHEMBL26977284

Cc1n[nH]cc1Nc1ncc(C#N)c(-n2cc(C)c3cc([N+](=O)[O-])ccc32)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 3/20 0.38
▸ CDK1 P06493 2/20 0.38
▸ CDK7 P50613 2/20 0.38
▸ CDK9 P50750 2/20 0.38
▸ CCNT1 O60563 1/20 0.38
▸ CCNB1 P14635 1/20 0.38
▸ CCNA2 P20248 1/20 0.38
▸ CCNH P51946 1/20 0.38
▸ CCNA1 P78396 1/20 0.38
▸ GAA P10253 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ EGFR P00533 2/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ ELANE P08246 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ GLA P06280 1/20 0.33
▸ JAK2 O60674 2/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ BCL6 P41182 1/20 0.32

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
SCHEMBL26977144 0.90 JAK2 (0.38) CDK2CDK1CDK7CDK9GAA
SCHEMBL26977376 0.85 MAPT (0.36) EGFRMAPTLRRK2
SCHEMBL27241032 0.82 CCNT1 (0.42) CDK2CDK1CDK7CDK9CCNT1
SCHEMBL29928848 0.82 CCNT1 (0.42) CDK2CDK1CDK7CDK9CCNT1
SCHEMBL29929049 0.79 VCAM1 (0.41) GAAALDH1A1EGFRERBB2ELANE
SCHEMBL26977398 0.79 VCAM1 (0.41) GAAALDH1A1EGFRERBB2ELANE
SCHEMBL23611947 0.76 CDK2 (0.38) CDK2CDK1CDK7CDK9CCNT1
SCHEMBL26977200 0.74 MKNK2 (0.38) CDK2EGFRJAK2JAK1TYK2
SCHEMBL29929298 0.73 CDK2 (0.41) CDK2CDK1CDK7CDK9CCNT1
SCHEMBL29929752 0.73 CCNT1 (0.41) CDK2CDK9CCNT1GAAALDH1A1

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-4297873-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE Tyra Biosciences, Inc. (US) 2024-01-03 — — EP disclosed
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