SCHEMBL6225201

SCHEMBL6225201

COC(Cl)CCc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.44
AOC3 Q16853 1/20 0.41
KCNH2 Q12809 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
MAOB P27338 2/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
IDO1 P14902 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
AGXT P21549 2/20 0.38
SLC6A4 P31645 1/20 0.38

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
SCHEMBL8077730 0.82 HTT (0.53) TAAR1AOC3MAOBIDO1MEN1
SCHEMBL8071578 0.82 MMP12 (0.42) PPARGPPARAMEN1KMT2A
SCHEMBL810464 0.78 ALDH1A1 (0.38)
SCHEMBL22850008 0.74 MMP12 (0.44) TAAR1AOC3KCNH2TMEM97SLC6A2
SCHEMBL436099 0.74 AOC3 (0.52) TAAR1AOC3KCNH2TMEM97SLC6A2
Hydrochloric Acid SCHEMBL27666375 0.72 AOC3 (0.50) TAAR1AOC3KCNH2TMEM97SLC6A2
Ammonia Solution, Strong SCHEMBL10725614 0.72 AOC3 (0.50) TAAR1AOC3KCNH2TMEM97SLC6A2
SCHEMBL28210143 0.72 TAAR1 (0.48) TAAR1AOC3KCNH2TMEM97SLC6A2
Hydrochloric Acid SCHEMBL4443325 0.72 IDO1 (0.51) AOC3PPARGPPARAIDO1MEN1
SCHEMBL21175025 0.71 TAAR1 (0.47) TAAR1AOC3KCNH2TMEM97SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411942-A4 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS SYNAPTIC PHARMA CORP (US) 2005-01-26 EP disclosed
EP-1411942-A1 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS Synaptic Pharmaceutical Corporation (US) 2004-04-28 EP disclosed
WO-2003004027-A1 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2003-01-16 WO disclosed