SCHEMBL11364338

SCHEMBL11364338

CCCC[C@H](C)C(=O)COP(C)(C)=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 5/20 0.42
CA1 P00915 3/20 0.40
CYP3A4 P08684 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CA2 P00918 2/20 0.34
SMPD1 P17405 3/20 0.33
ACE2 Q9BYF1 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL11437311 0.86 FDPS (0.47) FDPSCA1SMPD1
SCHEMBL11510893 0.85 CA1 (0.41) FDPSCA1CYP3A4L3MBTL1CA2
SCHEMBL9785226 0.83 FDPS (0.40) FDPSCA1CYP3A4L3MBTL1CA2
SCHEMBL11497648 0.83 FDPS (0.40) FDPSCA1CYP3A4L3MBTL1CA2
SCHEMBL28151694 0.76 TSHR (0.42)
SCHEMBL11296124 0.74
SCHEMBL9463468 0.73 CA1 (0.41) FDPSCA1CYP3A4CA2ACE2
SCHEMBL10731785 0.72 FDPS (0.44) FDPSCA1CYP3A4L3MBTL1CA2
SCHEMBL3286382 0.72 CA1 (0.52) FDPSCA1CA2ACE2MAPK1
SCHEMBL19004774 0.72 CA1 (0.52) FDPSCA1CA2ACE2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4303670-A Bicyclic prostaglandins and process for their preparation FARMITALIA CARLO ERBA (IT) 1981-12-01 US disclosed
US-4277491-A HYPOTENSIVE, VASODILATORY, ANTI-AGGREGATING, LUTEOLYTIC, CYTOPROTECTIVE FARMITALIA CARLO ERBA, S.P.A. (IT) 1981-07-07 US disclosed
US-4262016-A HYPOTENSIVE, VASODILATORY, ANTI-THROMBOTIC FARMITALIA CARLO ERBA S.P.A. (IT) 1981-04-14 US disclosed
US-4254137-A Bicyclic prostaglandins and process for their preparation FARMITALIA CARLO ERBA S.P.A. (IT) 1981-03-03 US disclosed
US-4230721-A 2H-CYCLOPENTA/B/FURAN DERIVATIVES FARMITALIA CARLO ERBA S.P.A. (IT) 1980-10-28 US disclosed