SCHEMBL29929298

SCHEMBL29929298

Cc1cn(-c2nc(Nc3cn[nH]c3)ncc2F)c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 5/20 0.41
▸ CCNT1 O60563 3/20 0.41
▸ CCNE1 P24864 3/20 0.41
▸ CDK9 P50750 3/20 0.41
▸ CCNE2 O96020 1/20 0.41
▸ JAK2 O60674 2/20 0.37
▸ JAK1 P23458 2/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ KDR P35968 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ PTK2 Q05397 1/20 0.35
▸ CDK4 P11802 3/20 0.35
▸ SYK P43405 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ PLK1 P53350 1/20 0.34
▸ BRD4 O60885 1/20 0.34
▸ CDK1 P06493 2/20 0.33
▸ CCNB1 P14635 2/20 0.33
▸ CDK7 P50613 2/20 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
SCHEMBL26977050 0.81 SYK (0.49) CDK2JAK2JAK1TYK2MEN1
SCHEMBL29929725 0.81 CCNT1 (0.41) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL26980190 0.81 CCNT1 (0.41) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL26980444 0.81 CCNT1 (0.41) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL29929752 0.81 CCNT1 (0.41) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL26977217 0.80 JAK1 (0.43) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL27241016 0.80 CCNT1 (0.39) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL26977291 0.80 CCNT1 (0.39) CDK2CCNT1CCNE1CDK9CCNE2
SCHEMBL29113552 0.78 — —
SCHEMBL29929291 0.78 MAPT (0.41) MEN1KMT2AMAPTS1PR4

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-4297873-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE Tyra Biosciences, Inc. (US) 2024-01-03 — — EP disclosed
WO-2022182972-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE TYRA BIOSCIENCES, INC. (US) 2022-09-01 — — WO disclosed
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