SCHEMBL9764554

SCHEMBL9764554

Fc1cccc(Oc2cccc(F)c2C2CCC2)c1C1CCC1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.66
HTR1A P08908 12/20 0.66
SLC6A3 Q01959 9/20 0.66
SLC6A4 P31645 6/20 0.66
ABCB1 P08183 1/20 0.44
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
KDM1A O60341 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
SCHEMBL31614220 0.85 HTR1A (0.50) SLC6A2HTR1ASLC6A3SLC6A4ABCB1
SCHEMBL24685527 0.83 ABCB1 (0.56) SLC6A2HTR1ASLC6A3SLC6A4ABCB1
SCHEMBL31614215 0.76 DRD2 (0.46) SLC6A2HTR1ASLC6A3SLC6A4
SCHEMBL31614201 0.74 ABCB1 (0.45) SLC6A2HTR1ASLC6A3SLC6A4ABCB1
SCHEMBL10994234 0.74 ABCB1 (0.60) SLC6A2HTR1ASLC6A3SLC6A4ABCB1
SCHEMBL9764550 0.73 HTR1A (0.43) SLC6A2HTR1ASLC6A3SLC6A4
SCHEMBL24105749 0.72 ERN1 (0.48) SLC6A2HTR1ASLC6A3SLC6A4ABCB1
SCHEMBL20606723 0.71 OPRL1 (0.60) SLC6A2HTR1ASLC6A3SLC6A4ABCB1
SCHEMBL5020016 0.70 HTR1A (0.70) SLC6A2HTR1ASLC6A3SLC6A4
SCHEMBL31614135 0.70 ABCB1 (0.45) SLC6A2HTR1ASLC6A3SLC6A4ABCB1

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