SCHEMBL24339519

SCHEMBL24339519

C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](CO[PH](O)=S)[C@@H](O)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.33
▸ TMPRSS2 O15393 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
SCHEMBL24407360 0.84 TMPRSS2 (0.46) POLRMTTMPRSS2
SCHEMBL10120861 0.83 TMPRSS2 (0.41) POLRMTTMPRSS2
SCHEMBL24312549 0.83 POLRMT (0.35) POLRMTTMPRSS2
SCHEMBL18666902 0.83 POLRMT (0.33) POLRMTTMPRSS2
SCHEMBL20144199 0.83 POLRMT (0.33) POLRMTTMPRSS2
SCHEMBL20078675 0.82 POLRMT (0.43) POLRMT
SCHEMBL15998195 0.82 POLRMT (0.35) POLRMTTMPRSS2
SCHEMBL26944457 0.82 POLRMT (0.33) POLRMTTMPRSS2
SCHEMBL24917062 0.82 POLRMT (0.34) POLRMTTMPRSS2
SCHEMBL24312556 0.82 RIPK1 (0.34) POLRMTTMPRSS2

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-2022081973-A1 PHOSPHOLIPID COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2022-04-21 — — WO disclosed
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