SCHEMBL29929030

SCHEMBL29929030

Cc1cn(-c2nc(Nc3cnn(C)c3C)ncc2F)c2ccc(N)cc12

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 7/20 0.42
▸ MAPK1 P28482 3/20 0.41
▸ SYK P43405 8/20 0.37
▸ KDR P35968 2/20 0.36
▸ MAP4K1 Q92918 1/20 0.35
▸ MAPK3 P27361 1/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ PIP4K2A P48426 1/20 0.31

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
SCHEMBL26980293 1.00 LRRK2 (0.42) LRRK2MAPK1SYKKDRMAP4K1
SCHEMBL29929758 0.85 LRRK2 (0.44) LRRK2MAPK1SYKKDRMAP4K1
SCHEMBL26980380 0.85 LRRK2 (0.44) LRRK2MAPK1SYKKDRMAP4K1
SCHEMBL29929725 0.84 CCNT1 (0.41) LRRK2MAPK1SYKKDRMAPK3
SCHEMBL26980444 0.84 CCNT1 (0.41) LRRK2MAPK1SYKKDRMAPK3
SCHEMBL29113546 0.83 LRRK2 (0.39) LRRK2MAPK1SYKKDRMAPK3
SCHEMBL29113545 0.83 LRRK2 (0.36) LRRK2MAPK1SYKKDRMAPK3
SCHEMBL29929431 0.81 EGFR (0.42) —
SCHEMBL26980771 0.81 EGFR (0.42) —
SCHEMBL29929221 0.78 JAK3 (0.46) LRRK2SYKKDRMAP4K1

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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