SCHEMBL9325909

SCHEMBL9325909

CCCCCCCCCC(=O)O[C@H]1CCC=C1C

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.56
PRKCA P17252 6/20 0.43
DGKA P23743 1/20 0.41
STAT3 P40763 1/20 0.41
CYP19A1 P11511 4/20 0.40

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
SCHEMBL9325980 1.00 NAAA (0.56) NAAAPRKCADGKASTAT3CYP19A1
SCHEMBL9848760 0.98 NAAA (0.54) NAAAPRKCASTAT3CYP19A1
SCHEMBL9325912 0.98 NAAA (0.54) NAAAPRKCASTAT3CYP19A1
SCHEMBL9325987 0.98 NAAA (0.54) NAAAPRKCASTAT3CYP19A1
SCHEMBL20623146 0.90 NAAA (0.55) NAAAPRKCASTAT3CYP19A1
SCHEMBL9325971 0.88 NAAA (0.39) NAAACYP19A1
SCHEMBL9325977 0.88 NAAA (0.39) NAAACYP19A1
SCHEMBL9325974 0.88 NAAA (0.39) NAAACYP19A1
SCHEMBL9325970 0.81 CHRM2 (0.36) NAAACYP19A1
SCHEMBL9326867 0.81 CHRM2 (0.36) NAAACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0414453-B1 Optically active cyclopentenols and process for preparing the same CHISSO CORP (JP) 1994-02-23 EP disclosed
US-5107039-A Intermediates for asymmetric synthesis of steroids and alkaloids CHISSO CORPORATION (JP) 1992-04-21 US disclosed
EP-0414453-A1 Optically active cyclopentenols and process for preparing the same Chisso Corporation (JP) 1991-02-27 EP disclosed