SCHEMBL23873239

SCHEMBL23873239

C=C1CNCCC1c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.41
HTR2C P28335 4/20 0.39
SCN10A Q9Y5Y9 1/20 0.38
NISCH Q9Y2I1 1/20 0.36
KDM1A O60341 2/20 0.36
RCOR1 Q9UKL0 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
GRIN2B Q13224 1/20 0.34
P2RY14 Q15391 1/20 0.33
MAOB P27338 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL2298335 0.74 HTR2C (0.61) EPHX1HTR2CSCN10ANISCHCTSL
Hydrochloric Acid SCHEMBL4893644 0.73 HTR2C (0.62) EPHX1HTR2CSCN10AKDM1ARCOR1
SCHEMBL25307338 0.72 HTR3A (0.54) EPHX1HTR2CSCN10A
SCHEMBL1247076 0.71 SLC6A4 (0.39) EPHX1HTR2CGRIN2BSLC6A4
SCHEMBL22944159 0.71 SCN10A (0.61) HTR2CSCN10A
SCHEMBL19580559 0.69 HTR2C (0.48) EPHX1HTR2CSCN10ANISCHKDM1A
SCHEMBL3121912 0.69 HTR2C (0.45) EPHX1HTR2CSCN10ANISCHKDM1A
SCHEMBL1673897 0.68 HRH1 (0.59) EPHX1HTR2C
SCHEMBL4564168 0.68 L3MBTL1 (0.47) EPHX1HTR2CNISCHKDM1ARCOR1
SCHEMBL20588412 0.68 SSTR1 (0.44) EPHX1HTR2CSCN10AKDM1ARCOR1

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
WO-2021191384-A1 ARYL PIPERIDINES AS MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 WO disclosed