SCHEMBL8970920

SCHEMBL8970920

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

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 17/20 0.60
DRD2 P14416 4/20 0.58
DRD3 P35462 2/20 0.49
LMNA P02545 1/20 0.49
HTR1A P08908 1/20 0.46
GMNN O75496 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
THPO P40225 1/20 0.46
MTOR P42345 1/20 0.46
BLM P54132 1/20 0.46
GRIN1 Q05586 1/20 0.46
GRIN2B Q13224 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL8970816 1.00 SIGMAR1 (0.60) SIGMAR1DRD2DRD3LMNAHTR1A
SCHEMBL9091624 0.99 SIGMAR1 (0.61) SIGMAR1DRD2DRD3LMNAHTR1A
SCHEMBL8970635 0.94 SIGMAR1 (0.56) SIGMAR1DRD2HTR1ATHPO
SCHEMBL8970701 0.94 SIGMAR1 (0.56) SIGMAR1DRD2HTR1A
SCHEMBL8971276 0.93 SIGMAR1 (0.56) SIGMAR1DRD2DRD3LMNAGMNN
SCHEMBL9093201 0.93 DRD2 (0.64) SIGMAR1DRD2DRD3LMNA
SCHEMBL9092165 0.93 SIGMAR1 (0.57) SIGMAR1DRD2HTR1A
SCHEMBL16053652 0.93 SIGMAR1 (0.57) SIGMAR1DRD2HTR1ATHPO
SCHEMBL8971363 0.89 SIGMAR1 (0.58) SIGMAR1HTR1A
SCHEMBL8970702 0.89 SIGMAR1 (0.58) SIGMAR1HTR1A

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