SCHEMBL30184363

SCHEMBL30184363

CCCCOC(=O)N1CCc2cc(OC)c(Nc3ncc(Cl)c(Nc4ccc(O)cc4P(C)(C)=O)n3)cc2C1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 11/20 0.60
▸ ALK Q9UM73 9/20 0.53
▸ INSR P06213 3/20 0.52
▸ IGF1R P08069 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
SCHEMBL30183907 0.90 MAP4K1 (0.56) MAP4K1ALKINSRIGF1R
SCHEMBL25338924 0.89 MAP4K1 (0.66) MAP4K1ALKINSRIGF1R
SCHEMBL30447570 0.89 MAP4K1 (0.62) MAP4K1ALKINSRIGF1R
SCHEMBL25338206 0.89 MAP4K1 (0.62) MAP4K1ALKINSRIGF1R
SCHEMBL30183987 0.85 MAP4K1 (0.81) MAP4K1ALK
SCHEMBL25338147 0.85 MAP4K1 (0.81) MAP4K1ALK
Hydrochloric Acid SCHEMBL25337589 0.84 MAP4K1 (0.80) MAP4K1ALK
SCHEMBL25340318 0.79 MAP4K1 (0.57) MAP4K1ALKINSR
SCHEMBL30183984 0.79 MAP4K1 (0.57) MAP4K1ALKINSR
SCHEMBL25338626 0.79 MAP4K1 (0.61) MAP4K1ALKINSR

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-4367123-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS Glenmark Specialty S.A. (CH) 2024-05-15 — — EP disclosed
WO-2023281417-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALTY S.A. (CH) 2023-01-12 — — WO disclosed
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