SCHEMBL5500092

SCHEMBL5500092

OC1(CCCc2cccc(C(F)(F)F)c2Cl)CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
REN P00797 2/20 0.39
CYP3A4 P08684 2/20 0.39
KCNH2 Q12809 2/20 0.39
TACR1 P25103 2/20 0.39
P2RX7 Q99572 12/20 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
SCHEMBL5499300 0.92 SLC6A2 (0.45) FFAR4SLC6A2SLC6A4RENCYP3A4
SCHEMBL2785289 0.86 FFAR4 (0.43) FFAR4SLC6A2SLC6A4TACR1P2RX7
SCHEMBL5499318 0.83 KCNH2 (0.33) FFAR4SLC6A2SLC6A4RENCYP3A4
SCHEMBL5500299 0.83 TAAR1 (0.42) SLC6A2SLC6A4RENCYP3A4KCNH2
SCHEMBL5495293 0.82 P2RX7 (0.38) FFAR4SLC6A2SLC6A4KCNH2TACR1
SCHEMBL5499100 0.79 KCNH2 (0.41) SLC6A2SLC6A4RENCYP3A4KCNH2
SCHEMBL5493818 0.78 FFAR4 (0.41) FFAR4SLC6A2SLC6A4RENCYP3A4
SCHEMBL5499363 0.78 TACR1 (0.43) FFAR4SLC6A2SLC6A4TACR1P2RX7
SCHEMBL5495138 0.77 KCNH2 (0.37) SLC6A2SLC6A4RENKCNH2TACR1
SCHEMBL5498980 0.75 GPR84 (0.46) SLC6A2SLC6A4KCNH2TACR1P2RX7

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-1765779-A1 NEW SUBSTITUTED PIPERIDINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2007-03-28 EP claimed
WO-2005121092-A1 NEW SUBSTITUTED PIPERIDINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2005-12-22 WO claimed