SCHEMBL5495876

SCHEMBL5495876

OC1(CCc2cccc(F)c2F)CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.38
SLC6A2 P23975 4/20 0.36
SLC6A4 P31645 4/20 0.36
HTR1A P08908 3/20 0.36
SLC6A3 Q01959 3/20 0.36
GAA P10253 1/20 0.35
ROCK2 O75116 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2A P28223 1/20 0.34
GRIN2B Q13224 3/20 0.33
REN P00797 1/20 0.33
CXCR2 P25025 1/20 0.32
OPRM1 P35372 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
RIPK1 Q13546 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
HDAC4 P56524 1/20 0.31
METAP2 P50579 1/20 0.30

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
SCHEMBL4390004 0.91 FFAR4 (0.39) FFAR4SLC6A2SLC6A4HTR1ASLC6A3
SCHEMBL27618109 0.88 TAAR1 (0.43) SLC6A2SLC6A4HTR1ASLC6A3HTR2C
Hydrochloric Acid SCHEMBL1475155 0.86 TAAR1 (0.42) SLC6A2SLC6A4HTR1ASLC6A3HTR2C
SCHEMBL5501439 0.85 FFAR4 (0.40) FFAR4SLC6A2SLC6A4SLC6A3HTR2C
SCHEMBL5498352 0.85 DRD2 (0.34) SLC6A2SLC6A4HTR1ASLC6A3HTR2C
SCHEMBL5499363 0.83 TACR1 (0.43) FFAR4SLC6A2SLC6A4SLC6A3HTR2C
SCHEMBL5494489 0.80 SLC6A2 (0.40) SLC6A2SLC6A4HTR1ASLC6A3HTR2A
SCHEMBL5493818 0.77 FFAR4 (0.41) FFAR4SLC6A2SLC6A4SLC6A3HTR2C
SCHEMBL5499318 0.77 KCNH2 (0.33) FFAR4SLC6A2SLC6A4HTR1ASLC6A3
SCHEMBL5498188 0.77 HTR1A (0.48) SLC6A2SLC6A4HTR1ASLC6A3

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 4 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
EP-1765779-A1 NEW SUBSTITUTED PIPERIDINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2007-03-28 EP disclosed
WO-2005121092-A1 NEW SUBSTITUTED PIPERIDINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2005-12-22 WO disclosed