SCHEMBL9764550

SCHEMBL9764550

Fc1c(Oc2cccc(C3CCC3)c2F)cccc1C1CCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.43
SLC6A2 P23975 9/20 0.43
SLC6A4 P31645 9/20 0.43
SLC6A3 Q01959 7/20 0.41
FEN1 P39748 9/20 0.39
ALOX5AP P20292 8/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
HTR2C P28335 1/20 0.36

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
SCHEMBL2399633 0.74 PTGDR2 (0.57) HTR1ASLC6A2SLC6A4SLC6A3PTGDR2
SCHEMBL9764554 0.73 SLC6A2 (0.66) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL9233206 0.72 HTR2C (0.43) HTR1ASLC6A2SLC6A4SLC6A3FEN1
SCHEMBL29691690 0.72 HTR2C (0.43) HTR1ASLC6A2SLC6A4SLC6A3FEN1
SCHEMBL4124303 0.72 PTGDR2 (0.42) HTR1ASLC6A2SLC6A4PTGDR2
SCHEMBL4125235 0.71 PTGDR2 (0.41) HTR1AFEN1PTGDR2
SCHEMBL9628619 0.71 HTR2C (0.46) HTR1ASLC6A2SLC6A4FEN1ALOX5AP
SCHEMBL30945150 0.70 SLC6A2 (0.66) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL13545695 0.69 HTR2C (0.44) HTR1ASLC6A2SLC6A4FEN1HTR2C
SCHEMBL268584 0.69 PTGS2 (0.41) FEN1ALOX5APPTGDR2

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-0428708-A1 PROCESS FOR PREPARING A POLYMER HAVING PERFLUOROCYCLOBUTANE RINGS AND POLYMERS CONTAINING PERFLUOROCYCLOBUTANE RINGS. DOW CHEMICAL CO (US) 1991-05-29 EP disclosed
WO-1990015082-A1 PROCESS FOR PREPARING A POLYMER HAVING PERFLUOROCYCLOBUTANE RINGS AND POLYMERS CONTAINING PERFLUOROCYCLOBUTANE RINGS THE DOW CHEMICAL COMPANY (US) 1990-12-13 WO disclosed