SCHEMBL7614360

SCHEMBL7614360

O=C(O)NC1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(Cc2ccc(Cl)cc2)C1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 17/20 0.71
TACR3 P29371 2/20 0.58
RHOC P08134 3/20 0.55
RHOA P61586 3/20 0.55

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
SCHEMBL8500550 1.00 TACR1 (0.71) TACR1TACR3RHOCRHOA
SCHEMBL7614357 1.00 TACR1 (0.71) TACR1TACR3RHOCRHOA
SCHEMBL7611998 0.91 TACR1 (0.82) TACR1TACR3RHOCRHOA
SCHEMBL7612006 0.91 TACR1 (0.82) TACR1TACR3RHOCRHOA
SCHEMBL7610214 0.91 TACR1 (0.85) TACR1TACR3
SCHEMBL7610216 0.91 TACR1 (0.85) TACR1TACR3
SCHEMBL8501913 0.90 TACR1 (0.73) TACR1TACR3RHOCRHOA
SCHEMBL7611711 0.90 TACR1 (0.68) TACR1TACR3RHOCRHOA
SCHEMBL7611706 0.90 TACR1 (0.68) TACR1TACR3RHOCRHOA
SCHEMBL8499944 0.89 TACR1 (0.72) TACR1TACR3RHOCRHOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783490-B1 1-ACYL-4-ALIPHATIC AMINOPIPERIDINE COMPOUNDS NOVARTIS AG (CH) 2002-02-06 EP claimed
EP-0783490-A1 1-ACYL-4-ALIPHATYLAMINOPIPERIDINE COMPOUNDS Novartis AG (CH) 1997-07-16 EP claimed
WO-1996010562-A1 1-ACYL-4-ALIPHATYLAMINOPIPERIDINE COMPOUNDS NOVARTIS AG (CH) 1996-04-11 WO claimed
EP-0783490-B1 1-ACYL-4-ALIPHATIC AMINOPIPERIDINE COMPOUNDS NOVARTIS AG (CH) 2002-02-06 EP disclosed
US-5935951-A ANTAGONIST AGAINST SUBSTANCE P NOVARTIS FINANCE CORPORATION (US) 1999-08-10 US disclosed