SCHEMBL8970635

SCHEMBL8970635

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

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.56
DRD2 P14416 1/20 0.49
SLC6A4 P31645 3/20 0.48
SLC6A3 Q01959 2/20 0.48
HTR1A P08908 2/20 0.48
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP2D6 P10635 1/20 0.45
THPO P40225 1/20 0.45

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
SCHEMBL16053652 0.99 SIGMAR1 (0.57) SIGMAR1DRD2SLC6A4SLC6A3HTR1A
SCHEMBL8971363 0.95 SIGMAR1 (0.58) SIGMAR1SLC6A4SLC6A3HTR1A
SCHEMBL8970702 0.95 SIGMAR1 (0.58) SIGMAR1SLC6A4SLC6A3HTR1A
SCHEMBL8971378 0.94 SIGMAR1 (0.60) SIGMAR1DRD2SLC6A4SLC6A3HTR1A
SCHEMBL8970920 0.94 SIGMAR1 (0.60) SIGMAR1DRD2HTR1ATHPO
SCHEMBL8970816 0.94 SIGMAR1 (0.60) SIGMAR1DRD2HTR1ATHPO
SCHEMBL9091624 0.93 SIGMAR1 (0.61) SIGMAR1DRD2HTR1ATHPO
SCHEMBL8971631 0.89 SLC6A4 (0.56) SIGMAR1SLC6A4SLC6A3HTR1AMAPK1
SCHEMBL8971350 0.88 SLC6A4 (0.54) SIGMAR1SLC6A4SLC6A3HTR1A
Hydrochloric Acid SCHEMBL8970739 0.88 SLC6A4 (0.55) SIGMAR1SLC6A4SLC6A3HTR1AMAPK1

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 6 patents. 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
US-5225416-A 1,2,3,6-TETRAHYDROPYRIDINE DERIVATIVES USEFUL FOR IMPROVING CEREBRAL BLOOD CIRCULATION RICHTER GEDEON VEGYESZETI TERMEKEK GYARA RT. (HU) 1993-07-06 US claimed
EP-0490560-A1 1,2,3,6-Tetrahydropyridine derivatives RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1992-06-17 EP claimed
EP-0490560-B1 1,2,3,6-Tetrahydropyridine derivatives RICHTER GEDEON VEGYESZET (HU) 1996-03-20 EP disclosed
US-5225416-A 1,2,3,6-TETRAHYDROPYRIDINE DERIVATIVES USEFUL FOR IMPROVING CEREBRAL BLOOD CIRCULATION RICHTER GEDEON VEGYESZETI TERMEKEK GYARA RT. (HU) 1993-07-06 US disclosed
EP-0490560-A1 1,2,3,6-Tetrahydropyridine derivatives RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1992-06-17 EP disclosed