Phosphine

Phosphine

SCHEMBL24869396

COc1cc2c(cc1Nc1ncc(Cl)c(Nc3cc(C)c(S)cc3OP(C)C)n1)CN(C)CC2.P

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 16/20 0.61
▸ ALK Q9UM73 4/20 0.59
▸ MET P08581 2/20 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
Phosphine SCHEMBL25950504 0.87 MAP4K1 (0.63) MAP4K1ALKMET
Phosphine SCHEMBL25950522 0.86 MAP4K1 (0.64) MAP4K1ALKMET
Phosphine SCHEMBL25950836 0.86 MAP4K1 (0.63) MAP4K1ALKMET
Phosphine SCHEMBL24870174 0.86 MAP4K1 (0.64) MAP4K1ALKMET
Phosphine SCHEMBL25950804 0.85 MAP4K1 (0.61) MAP4K1ALK
Phosphine SCHEMBL25950677 0.85 MAP4K1 (0.63) MAP4K1ALKMET
Phosphine SCHEMBL25950782 0.84 ALK (0.62) MAP4K1ALKMET
Phosphine SCHEMBL25950858 0.83 MAP4K1 (0.60) MAP4K1ALKMET
Phosphine SCHEMBL25950342 0.82 ALK (0.61) MAP4K1ALK
Phosphine SCHEMBL25950732 0.82 ALK (0.66) MAP4K1ALKMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023281417-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALTY S.A. (CH) 2023-01-12 — — WO disclosed
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