SCHEMBL8971363

SCHEMBL8971363

OC(CCN1CC=C(c2ccc(F)cc2)CC1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.58
HTR1A P08908 4/20 0.53
SLC6A4 P31645 4/20 0.53
SLC6A3 Q01959 3/20 0.53
SLC6A2 P23975 1/20 0.47

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
SCHEMBL8970702 1.00 SIGMAR1 (0.58) SIGMAR1HTR1ASLC6A4SLC6A3SLC6A2
SCHEMBL8970635 0.95 SIGMAR1 (0.56) SIGMAR1HTR1ASLC6A4SLC6A3
SCHEMBL16053652 0.94 SIGMAR1 (0.57) SIGMAR1HTR1ASLC6A4SLC6A3
SCHEMBL8971350 0.94 SLC6A4 (0.54) SIGMAR1HTR1ASLC6A4SLC6A3SLC6A2
SCHEMBL11793198 0.92 SIGMAR1 (0.56) SIGMAR1SLC6A4SLC6A3
SCHEMBL8971631 0.91 SLC6A4 (0.56) SIGMAR1HTR1ASLC6A4SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL8970739 0.90 SLC6A4 (0.55) SIGMAR1HTR1ASLC6A4SLC6A3SLC6A2
SCHEMBL8970816 0.89 SIGMAR1 (0.60) SIGMAR1HTR1A
SCHEMBL8970920 0.89 SIGMAR1 (0.60) SIGMAR1HTR1A
SCHEMBL8971378 0.89 SIGMAR1 (0.60) SIGMAR1HTR1ASLC6A4SLC6A3

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-0490560-B1 1,2,3,6-Tetrahydropyridine derivatives RICHTER GEDEON VEGYESZET (HU) 1996-03-20 EP claimed