SCHEMBL19302870

SCHEMBL19302870

CC(C)(C)OC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)CCC2(O)c3ccccc3C(O)C2(F)F)[C@H]2OC(C)(C)O[C@H]21

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL20508960 1.00 RXFP1 (0.42) RXFP1
SCHEMBL19302872 0.81 RXFP1 (0.42) RXFP1
SCHEMBL22837891 0.80 RXFP1 (0.51) RXFP1
SCHEMBL19302765 0.80 RXFP1 (0.43) RXFP1
SCHEMBL19302804 0.79 RXFP1 (0.59) RXFP1
SCHEMBL19302919 0.78 RXFP1 (0.41) RXFP1
SCHEMBL19302748 0.78 RXFP1 (0.41) RXFP1
SCHEMBL19302916 0.78 RXFP1 (0.41) RXFP1
SCHEMBL19302706 0.78 — —
SCHEMBL19302707 0.78 — —

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-2017059411-A9 INHIBITORS OF MENAQUINONE BIOSYNTHESIS MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2017-08-31 — — WO disclosed
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