SCHEMBL8662302

SCHEMBL8662302

O=[C]C1CNCCN1C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.36
▸ OPRM1 P35372 1/20 0.34
▸ OPRD1 P41143 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ OPRL1 P41146 1/20 0.34
▸ ACHE P22303 3/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ P4HB P07237 1/20 0.33
▸ SLC6A2 P23975 3/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ HTR2C P28335 2/20 0.32
▸ HTR2B P41595 2/20 0.32

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
SCHEMBL21831877 0.79 SIGMAR1 (0.39) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21831186 0.79 SIGMAR1 (0.39) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21831184 0.79 SIGMAR1 (0.39) SIGMAR1OPRM1OPRD1OPRK1OPRL1
Hydrochloric Acid SCHEMBL30910922 0.78 SIGMAR1 (0.38) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL3901287 0.77 OPRM1 (0.40) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21831009 0.76 OPRD1 (0.39) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21910237 0.75 OPRM1 (0.40) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21831083 0.75 SIGMAR1 (0.40) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21831226 0.75 OPRM1 (0.40) SIGMAR1OPRM1OPRD1OPRK1OPRL1
SCHEMBL21831225 0.75 OPRM1 (0.40) SIGMAR1OPRM1OPRD1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5843988-A Cyclopropachromencarboxylic acid derivatives SUNTORY LIMITED (JP) 1998-12-01 — — US disclosed
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