SCHEMBL29929709

SCHEMBL29929709

C=CC(=O)Nc1ccc2c(c1)c(C)cn2-c1nc(Nc2ccc(N3CCOCC3)cc2)ncc1Cl

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 6/20 0.62
▸ JAK3 P52333 6/20 0.59
▸ JAK2 O60674 5/20 0.59
▸ JAK1 P23458 3/20 0.59
▸ TTK P33981 1/20 0.59
▸ EGFR P00533 7/20 0.53
▸ BLK P51451 3/20 0.53
▸ BMX P51813 1/20 0.53
▸ TYK2 P29597 2/20 0.52
▸ FLT3 P36888 3/20 0.51
▸ MAP3K7 O43318 1/20 0.51

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
SCHEMBL26980738 1.00 BTK (0.62) BTKJAK3JAK2JAK1TTK
SCHEMBL27240931 0.93 BTK (0.58) BTKJAK3JAK2JAK1TTK
SCHEMBL30931315 0.93 BTK (0.58) BTKJAK3JAK2JAK1TTK
SCHEMBL30931339 0.92 BTK (0.52) BTKJAK3JAK2JAK1TTK
SCHEMBL27240795 0.92 BTK (0.52) BTKJAK3JAK2JAK1TTK
SCHEMBL27240782 0.91 BTK (0.56) BTKJAK3JAK2JAK1TTK
SCHEMBL27240881 0.91 BTK (0.60) BTKJAK3JAK2JAK1TTK
SCHEMBL26979838 0.91 BTK (0.56) BTKJAK3JAK2JAK1TTK
SCHEMBL27240825 0.90 EGFR (0.65) BTKJAK3JAK2JAK1TTK
SCHEMBL27240828 0.90 BTK (0.65) BTKJAK3JAK2JAK1TTK

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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