SCHEMBL8970701

SCHEMBL8970701

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

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 13/20 0.56
HTR1A P08908 3/20 0.51
DRD2 P14416 1/20 0.49
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
PPARG P37231 1/20 0.45
PPARA Q07869 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
SCHEMBL9092165 0.99 SIGMAR1 (0.57) SIGMAR1HTR1ADRD2SLC6A2SLC6A4
SCHEMBL8970924 0.95 SIGMAR1 (0.58) SIGMAR1HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL8971237 0.95 SIGMAR1 (0.58) SIGMAR1HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL8970920 0.94 SIGMAR1 (0.60) SIGMAR1HTR1ADRD2
SCHEMBL8970633 0.94 SIGMAR1 (0.60) SIGMAR1HTR1ADRD2SLC6A2SLC6A4
SCHEMBL8970816 0.94 SIGMAR1 (0.60) SIGMAR1HTR1ADRD2
SCHEMBL9091624 0.93 SIGMAR1 (0.61) SIGMAR1HTR1ADRD2
SCHEMBL8970673 0.93 SIGMAR1 (0.52) SIGMAR1HTR1ADRD2SLC6A2SLC6A4
SCHEMBL9090508 0.92 SIGMAR1 (0.57) SIGMAR1HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL9090414 0.90 SIGMAR1 (0.49) SIGMAR1HTR1ADRD2SLC6A2SLC6A4

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