SCHEMBL9510310

SCHEMBL9510310

C=CCC1CCC(C=O)(CC=C)C1=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
FAAH O00519 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL11331123 0.71 FAAH (0.35) GAAHPGDMAPK1FAAH
SCHEMBL8830706 0.66 CYP3A4 (0.33) FAAH
SCHEMBL10497325 0.66 FAAH (0.33) GAAHPGDMAPK1FAAH
SCHEMBL14879904 0.66 CYP19A1 (0.40) GAAHPGDMAPK1FAAHALDH1A1
SCHEMBL9401103 0.63 POLB (0.30)
SCHEMBL6402909 0.63 FAAH (0.40) GAAHPGDMAPK1FAAHALDH1A1
SCHEMBL11225083 0.63 AKR1C3 (0.36) FAAH
SCHEMBL9509085 0.61 TDP1 (0.33) HPGDALDH1A1
SCHEMBL4560047 0.60 ALDH1A1 (0.33) FAAHALDH1A1
SCHEMBL19302160 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0398099-B1 PROCESS FOR THE PRODUCTION OF CYCLOPENTANONES BASF Aktiengesellschaft (DE) 1993-09-22 EP disclosed
EP-0398099-A1 Process for the production of cyclopentanones BASF Aktiengesellschaft (DE) 1990-11-22 EP disclosed