SCHEMBL19900673

SCHEMBL19900673

CC(C)(C)OC(=O)C(=O)OC(=O)[C@H]1C[C@@H](F)CN1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.35
SMYD3 Q9H7B4 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
SCHEMBL28476405 0.86 CTSC (0.35) CTSCSMYD3
SCHEMBL29308167 0.85 CTSC (0.39) CTSCSMYD3
SCHEMBL11448952 0.85 CTSC (0.39) CTSCSMYD3
SCHEMBL2500543 0.85 CTSC (0.39) CTSCSMYD3
SCHEMBL25384116 0.74 CTSC (0.38) CTSCSMYD3
SCHEMBL5065914 0.74 CTSC (0.38) CTSCSMYD3
SCHEMBL13403388 0.73 CTSC (0.45) CTSCSMYD3
SCHEMBL3546617 0.73 CTSC (0.45) CTSCSMYD3
SCHEMBL3553836 0.73 CTSC (0.45) CTSCSMYD3
SCHEMBL1336035 0.73 CTSC (0.45) CTSCSMYD3

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-3504212-A1 SUBSTITUTED PYRROLIZINE COMPOUNDS AND USES THEREOF Gilead Sciences, Inc. (US) 2019-07-03 EP disclosed
WO-2018039531-A1 SUBSTITUTED PYRROLIZINE COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2018-03-01 WO disclosed