SCHEMBL7347162

SCHEMBL7347162

O=C(O)[C@@H]1CC(Oc2ccc(F)cc2)CN1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.55
KCNH2 Q12809 6/20 0.55
GRIK1 P39086 2/20 0.43
GRIA2 P42262 2/20 0.43
EPHX2 P34913 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
SCHEMBL25361349 1.00 HRH3 (0.55) HRH3KCNH2GRIK1GRIA2EPHX2
SCHEMBL3180030 1.00 HRH3 (0.55) HRH3KCNH2GRIK1GRIA2EPHX2
SCHEMBL30471692 0.87 HRH3 (0.54) HRH3KCNH2EPHX2
SCHEMBL6943424 0.86 HRH3 (0.54) HRH3GRIK1GRIA2
SCHEMBL13584955 0.86 HRH3 (0.54) HRH3GRIK1GRIA2
SCHEMBL3448485 0.86 HRH3 (0.54) HRH3GRIK1GRIA2
SCHEMBL29380816 0.86 HRH3 (0.54) HRH3GRIK1GRIA2
SCHEMBL3180028 0.86 HRH3 (0.54) HRH3GRIK1GRIA2
SCHEMBL3448482 0.86 HRH3 (0.54) HRH3GRIK1GRIA2
SCHEMBL13357774 0.85 HRH3 (0.55) HRH3KCNH2GRIK1GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0053902-B1 PHOSPHINYLALKANOYL SUBSTITUTED PROLINES E.R. Squibb & Sons, Inc. (US) 1985-04-03 EP disclosed
US-4462943-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1984-07-31 US disclosed
US-4384123-A Phosphinylalkanoyl substituted prolines E. R. SQUIBB & SONS, INC. (US) 1983-05-17 US disclosed
US-4337201-A Phosphinylalkanoyl substituted prolines E. R. SQUIBB & SONS, INC. (US) 1982-06-29 US disclosed
EP-0053902-A1 Phosphinylalkanoyl substituted prolines E.R. Squibb & Sons, Inc. (US) 1982-06-16 EP disclosed
EP-0052991-A1 Carboxyalkyl amino acid derivatives of various substituted prolines E.R. Squibb & Sons, Inc. (US) 1982-06-02 EP disclosed
US-4316906-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-02-23 US disclosed