SCHEMBL11544149

SCHEMBL11544149

CC(C)NC(C)Cc1cccc(SC(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.46
SIGMAR1 Q99720 4/20 0.43
HTR2A P28223 3/20 0.43
HTR2B P41595 3/20 0.43
ADRA2C P18825 2/20 0.43
ADRA1A P35348 2/20 0.43
DRD3 P35462 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
OPRK1 P41145 1/20 0.43
CYP1A2 P05177 3/20 0.41
CYP2D6 P10635 3/20 0.41
APEX1 P27695 1/20 0.41
PMP22 Q01453 1/20 0.41
HTR2C P28335 2/20 0.39
CYP3A4 P08684 3/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
CETP P11597 2/20 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
SCHEMBL11544879 0.87 TAAR1 (0.50) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
Tiflorex SCHEMBL2108377 0.84 SIGMAR1 (0.63) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
Tiflorex SCHEMBL11551709 0.83 SIGMAR1 (0.62) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
SCHEMBL11545130 0.83 SIGMAR1 (0.48) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
SCHEMBL17449716 0.83 HTR2A (0.44) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
SCHEMBL11547028 0.82 SIGMAR1 (0.55) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
SCHEMBL11547646 0.81 HTR2A (0.58) SLC6A4SIGMAR1HTR2AHTR2BHTR2C
Hydrochloric Acid SCHEMBL11546088 0.80 HTR2A (0.57) SLC6A4SIGMAR1HTR2AHTR2BHTR2C
SCHEMBL11545201 0.79 SIGMAR1 (0.50) SLC6A4SIGMAR1HTR2AHTR2BADRA2C
SCHEMBL935243 0.74 EPHX1 (0.44) HTR2AHTR2BLMNAMAPTHTR2C

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
US-4129598-A ANOREXIGENIC AGENTS SYNTHELABO (FR) 1978-12-12 US claimed
US-4148923-A 1-(3'-Trifluoromethylthiophenyl)-2-ethylaminopropane pharmaceutical composition and method for treating obesity SYNTHELABO (FR) 1979-04-10 US disclosed
US-4129598-A ANOREXIGENIC AGENTS SYNTHELABO (FR) 1978-12-12 US disclosed