Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30151156

COC(=O)CCc1cccc(C(F)(F)F)c1F.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.41
FFAR4 Q5NUL3 2/20 0.41
P2RX7 Q99572 7/20 0.40
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
FFAR1 O14842 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
PTGS2 P35354 1/20 0.38
CTSS P25774 1/20 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
SCHEMBL30151178 0.83 FFAR4 (0.50) EPHX2FFAR4P2RX7GAAPOLB
SCHEMBL21015416 0.82 EPHX2 (0.51) EPHX2FFAR4GAAPOLBFFAR1
SCHEMBL9494344 0.81 EPHX2 (0.43) EPHX2GAAPOLBTDP1KDM4E
SCHEMBL31645683 0.80 P2RX7 (0.47) EPHX2P2RX7KDM4EPTGS2CTSS
SCHEMBL15287109 0.80 P2RX7 (0.44) EPHX2P2RX7GAAPOLBTDP1
SCHEMBL27643599 0.78 FFAR4 (0.43) EPHX2FFAR4P2RX7GAAPOLB
SCHEMBL29174148 0.77 PTGER1 (0.44) FFAR4FFAR1TDP1KDM4EALDH1A1
SCHEMBL20341728 0.76 IAPP (0.46) POLBTDP1KDM4EALDH1A1HTT
SCHEMBL12955273 0.76 CYP4F2 (0.43) GAAPOLBTDP1KDM4EALDH1A1
SCHEMBL2031772 0.75 SMN1; SMN2 (0.46) EPHX2P2RX7GAAPOLBALDH1A1

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-115551846-A 1,4,5,6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2022-12-30 CN disclosed