SCHEMBL29929159

SCHEMBL29929159

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

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 1/20 0.40
▸ JAK1 P23458 8/20 0.38
▸ JAK3 P52333 9/20 0.37
▸ TYK2 P29597 3/20 0.37
▸ AURKA O14965 6/20 0.37
▸ AURKB Q96GD4 5/20 0.37
▸ JAK2 O60674 6/20 0.36
▸ KDR P35968 1/20 0.36
▸ SYK P43405 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.35

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
SCHEMBL27240951 1.00 MAP4K1 (0.40) MAP4K1JAK1JAK3TYK2AURKA
SCHEMBL26977031 1.00 MAP4K1 (0.40) MAP4K1JAK1JAK3TYK2AURKA
SCHEMBL26977428 0.86 JAK3 (0.46) MAP4K1JAK1JAK3TYK2AURKA
SCHEMBL29929221 0.86 JAK3 (0.46) MAP4K1JAK1JAK3TYK2AURKA
SCHEMBL27241016 0.86 CCNT1 (0.39) MAP4K1JAK1JAK3TYK2AURKA
SCHEMBL26977291 0.86 CCNT1 (0.39) MAP4K1JAK1JAK3TYK2AURKA
SCHEMBL29113541 0.86 JAK3 (0.40) JAK1JAK3TYK2AURKAAURKB
SCHEMBL29113572 0.85 JAK3 (0.38) JAK1JAK3TYK2AURKAAURKB
SCHEMBL29113539 0.85 JAK3 (0.38) JAK1JAK3TYK2AURKAAURKB
SCHEMBL30931275 0.84 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 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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