SCHEMBL26977291

SCHEMBL26977291

Cc1cn(-c2nc(Nc3cnn(C[C@@H](C)O)c3)ncc2F)c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 1/20 0.39
▸ CCNE2 O96020 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ JAK1 P23458 8/20 0.37
▸ AURKA O14965 6/20 0.37
▸ AURKB Q96GD4 5/20 0.37
▸ SYK P43405 3/20 0.36
▸ KDR P35968 2/20 0.36
▸ JAK3 P52333 6/20 0.35
▸ JAK2 O60674 5/20 0.35
▸ TYK2 P29597 4/20 0.35
▸ MAP4K1 Q92918 1/20 0.34

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
SCHEMBL27241016 1.00 CCNT1 (0.39) CCNT1CCNE2CCNE1CDK2CDK9
SCHEMBL26977217 0.88 JAK1 (0.43) CCNT1CCNE2CCNE1CDK2CDK9
SCHEMBL29929159 0.86 MAP4K1 (0.40) JAK1AURKAAURKBSYKKDR
SCHEMBL27240951 0.86 MAP4K1 (0.40) JAK1AURKAAURKBSYKKDR
SCHEMBL26977031 0.86 MAP4K1 (0.40) JAK1AURKAAURKBSYKKDR
SCHEMBL27124698 0.82 JAK3 (0.48) JAK1JAK3JAK2
SCHEMBL26980179 0.82 JAK3 (0.48) JAK1JAK3JAK2
SCHEMBL29113541 0.82 JAK3 (0.40) JAK1AURKAAURKBJAK3JAK2
SCHEMBL30931275 0.82 JAK3 (0.48) JAK1JAK3JAK2
SCHEMBL26979923 0.82 JAK3 (0.48) JAK1JAK3JAK2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190849-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE TYRA BIOSCIENCES, INC. 2024-06-13 — — US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240190849-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE DPYD, TYMP, TYMS CCNT1 84/4885CCNE2 409/4885CCNE1 159/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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