SCHEMBL7410203

SCHEMBL7410203

COc1cc2c3c(n(CC(=O)O)c2cc1OC)CCC(O)C3

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.48

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
SCHEMBL7407231 0.89 PTGDR2 (0.56) PTGDR2
SCHEMBL7409122 0.77 PTGDR2 (0.44) PTGDR2
SCHEMBL7411899 0.71 TSHR (0.46) PTGDR2
SCHEMBL833770 0.69 PTGDR2 (0.66) PTGDR2
SCHEMBL833771 0.69 PTGDR2 (0.66) PTGDR2
SCHEMBL2311159 0.68 PTGDR2 (0.58) PTGDR2
SCHEMBL833448 0.68 PTGDR2 (0.64) PTGDR2
SCHEMBL2309234 0.67 PTGDR2 (0.72) PTGDR2
SCHEMBL832332 0.67 PTGDR2 (0.69) PTGDR2
SCHEMBL831426 0.67 PTGDR2 (0.69) PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4257952-A PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES STERLING DRUG INC. (US) 1981-03-24 US disclosed
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US disclosed
US-4062864-A ANALGESIC, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1977-12-13 US disclosed
US-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed