SCHEMBL9239267

SCHEMBL9239267

Cc1ccc(C[C@@H]2CN(C(=O)C=Cc3ccc(C(F)(F)F)cc3)CCN2C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1C

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 8/20 0.45
TACR1 P25103 6/20 0.42
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
OPRK1 P41145 1/20 0.38

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
SCHEMBL8477810 1.00 GPR183 (0.45) GPR183TACR1KCNH2HRH3MAOA
SCHEMBL9239257 1.00 GPR183 (0.45) GPR183TACR1KCNH2HRH3MAOA
SCHEMBL8478659 0.95 L3MBTL1 (0.42) GPR183TACR1
SCHEMBL8478660 0.95 L3MBTL1 (0.42) GPR183TACR1
SCHEMBL9236774 0.95 L3MBTL1 (0.42) GPR183TACR1
SCHEMBL9236781 0.95 L3MBTL1 (0.42) GPR183TACR1
SCHEMBL8480591 0.94 RHOC (0.44) GPR183TACR1
SCHEMBL9238971 0.94 RHOC (0.44) GPR183TACR1
SCHEMBL9238976 0.94 RHOC (0.44) GPR183TACR1
SCHEMBL8480595 0.94 RHOC (0.44) GPR183TACR1

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
EP-0655442-A1 Piperazine derivatives as Tachykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-05-31 EP disclosed