SCHEMBL6919211

SCHEMBL6919211

Cc1ccc(F)c(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCCN2)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.59
SLC6A3 Q01959 8/20 0.46
SLC6A2 P23975 6/20 0.46
SLC6A4 P31645 4/20 0.46
DHFR P00374 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GPR88 Q9GZN0 1/20 0.43

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
SCHEMBL26840798 0.82 SLC6A9 (0.73) SLC6A9SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL1798157 0.77 SLC6A9 (0.61) SLC6A9SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL1795282 0.76 SLC6A9 (0.76) SLC6A9SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL1795284 0.76 SLC6A9 (0.76) SLC6A9SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL3538359 0.76 SLC6A9 (0.60) SLC6A9SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL1689516 0.74 SLC6A9 (1.00) SLC6A9
SCHEMBL4589243 0.74 SLC6A9 (1.00) SLC6A9
SCHEMBL4589246 0.74 SLC6A9 (1.00) SLC6A9
SCHEMBL3536275 0.74 GPR88 (0.57) SLC6A9SLC6A3SLC6A2SLC6A4DHFR
Hydrochloric Acid SCHEMBL4588987 0.73 SLC6A9 (0.98) SLC6A9SLC6A3SLC6A2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004013100-A2 N-[PHENYL(PIPERIDIN-2-YL)METHYL]BENZAMIDE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2004-02-12 WO disclosed