Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30437577

CCCCCC(C)c1cccnc1C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.38
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
ALOX15 P16050 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
BLM P54132 1/20 0.38
AGER Q15109 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP1A2 P05177 1/20 0.38
PTPN1 P18031 1/20 0.37
GAA P10253 1/20 0.36
FAAH O00519 1/20 0.35
MYC P01106 1/20 0.35
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
S1PR4 O95977 1/20 0.34
S1PR1 P21453 1/20 0.34

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
SCHEMBL25452695 0.92 PTPN1 (0.42) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL5498417 0.84 KDM4E (0.46) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL29385201 0.82 KDM4E (0.39) KDM4EALDH1A1MAPTCYP3A4FAAH
SCHEMBL29117493 0.81 FAAH (0.39) KDM4EALDH1A1MAPTCYP3A4PTPN1
SCHEMBL30663266 0.80 PTPN1 (0.38) MLYCDPTPN1FAAHPPARAPPARG
SCHEMBL28770590 0.79 CYSLTR2 (0.47) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL30630403 0.79 BRD4 (0.49) KDM4EALDH1A1PPARAPPARG
SCHEMBL29117492 0.79 PTPN1 (0.40) PTPN1FAAHPPARAPPARG
SCHEMBL29788749 0.78 ALDH1A1 (0.44) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL24908450 0.78 KDM4E (0.49) KDM4EALDH1A1MAPTALOX15L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110177783-B Hormone receptor modulators for the treatment of metabolic conditions and disorders 阿德利克斯股份有限公司 2023-06-06 CN disclosed