SCHEMBL6231189

SCHEMBL6231189

OC[C@@H]1CCCCN1c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.48
CCNE2 O96020 1/20 0.46
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
CCNE1 P24864 1/20 0.46
CDK2 P24941 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TYMP P19971 2/20 0.41
PPARG P37231 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CUL4A Q13619 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
SLC18A3 Q16572 1/20 0.40

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
SCHEMBL1533287 1.00 FFAR1 (0.48) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL6645372 0.95 FFAR1 (0.52) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL11343485 0.95 FFAR1 (0.52) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL31058308 0.89 FFAR1 (0.40) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL3164051 0.84 MAP2K7 (0.44) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL28140950 0.83 FFAR1 (0.44) FFAR1PPARGSLC6A2SLC6A4SLC6A3
SCHEMBL28619213 0.83 FFAR1 (0.47) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL78175 0.83 ALDH1A1 (0.42) FFAR1CCNE2CDK4CCND1CCNE1
SCHEMBL3184089 0.83 FFAR1 (0.53) FFAR1KMT2ATYMPPPARGCUL4A
SCHEMBL3174734 0.83 TYMP (0.46) FFAR1CCNE2CDK4CCND1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1527048-A2 N- PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY Sanofi-Aventis (FR) 2005-05-04 EP disclosed
WO-2004013101-A2 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2004-02-12 WO disclosed