Trifluoroacetamide

Trifluoroacetamide

SCHEMBL6993217

COc1cccc(CC(O)C2CCNCC2)c1OC.NC(=O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.40
SLC6A4 P31645 6/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
GNAI3 P08754 1/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
TACR1 P25103 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL6989780 0.89 SLC6A2 (0.46) SLC6A2SLC6A4L3MBTL1LMNAGNAI3
Trifluoroacetamide SCHEMBL6991362 0.87 L3MBTL1 (0.36) SLC6A2SLC6A4L3MBTL1LMNAGNAI3
Methanesulfonamide SCHEMBL6999861 0.86 CA2 (0.44) SLC6A2SLC6A4L3MBTL1LMNAGNAI3
SCHEMBL6992863 0.77 L3MBTL1 (0.45) L3MBTL1LMNAALDH1A1KDM4E
SCHEMBL1596640 0.77 SLC6A2 (0.40) SLC6A2SLC6A4GNAI3SLC6A3
SCHEMBL6995954 0.76 L3MBTL1 (0.46) L3MBTL1LMNAALDH1A1KDM4ETACR1
SCHEMBL7904903 0.74 SLC6A2 (0.39) SLC6A2SLC6A4GNAI3ALDH1A1TP53
SCHEMBL6996955 0.71 L3MBTL1 (0.47) L3MBTL1LMNAALDH1A1KDM4E
SCHEMBL3048145 0.69 HTR2C (0.55) SLC6A2SLC6A4SLC6A3
SCHEMBL4225398 0.69 HTR2C (0.55) SLC6A2SLC6A4SLC6A3

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-1015446-B1 (4-PIPERIDINYL)-1H-2-BENZOPYRAN DERIVATIVES USEFUL AS ANTIPSYCHOTIC AGENTS AVENTIS PHARMA INC (US) 2003-04-02 EP disclosed
US-6004982-A SIDE EFFECT REDUCTION; SCHIZOPHRENIA HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed