SCHEMBL7239120

SCHEMBL7239120

OC[C@H]1CN(Cc2ccccc2)CC[C@H]1c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.52
ACHE P22303 3/20 0.52
BACE1 P56817 3/20 0.52
SLC18A3 Q16572 2/20 0.49
SIGMAR1 Q99720 2/20 0.49
CCR5 P51681 2/20 0.49
GBA1 P04062 1/20 0.49
DRD2 P14416 1/20 0.48
DRD4 P21917 1/20 0.48
SLC6A12 P48065 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
MCHR1 Q99705 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
SCHEMBL4029197 1.00 BCHE (0.52) BCHEACHEBACE1SLC18A3SIGMAR1
SCHEMBL7240145 1.00 BCHE (0.52) BCHEACHEBACE1SLC18A3SIGMAR1
SCHEMBL4029196 1.00 BCHE (0.52) BCHEACHEBACE1SLC18A3SIGMAR1
SCHEMBL4030955 1.00 BCHE (0.52) BCHEACHEBACE1SLC18A3SIGMAR1
SCHEMBL6576777 1.00 BCHE (0.52) BCHEACHEBACE1SLC18A3SIGMAR1
SCHEMBL7468131 0.91 CCR5 (0.58) BCHEACHEBACE1SIGMAR1CCR5
SCHEMBL7468128 0.91 CCR5 (0.58) BCHEACHEBACE1SIGMAR1CCR5
SCHEMBL7468123 0.91 CCR5 (0.58) BCHEACHEBACE1SIGMAR1CCR5
SCHEMBL7248619 0.88 ACHE (0.53) BCHEACHEBACE1SLC18A3SIGMAR1
SCHEMBL7248624 0.88 ACHE (0.53) BCHEACHEBACE1SLC18A3SIGMAR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6657062-B1 Chemical intermediates for paroxetine derivatives; formylation, resolution, reduction, salt formation, catalysis RICHTER GEDEON VEGYESSETI GYAR RT. (HU) 2003-12-02 US disclosed
EP-0923554-B1 N-BENZYLPIPERIDINE AND TETRAHYDROPYRIDINE DERIVATIVES RICHTER GEDEON VEGYESZET (HU) 2002-01-09 EP disclosed
EP-0923554-A1 N-BENZYLPIPERIDINE AND TETRAHYDROPYRIDINE DERIVATIVES RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1999-06-23 EP disclosed
WO-1998001424-A1 N-BENZYLPIPERIDINE AND TETRAHYDROPYRIDINE DERIVATIVES Richter Gedeon Vegyészeti Gyár Rt. (HU) 1998-01-15 WO disclosed