Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8029336

CN(C)c1ccccn1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLQ O75417 1/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 2/20 0.43
MDM2 Q00987 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
TSHR P16473 1/20 0.42
CES1 P23141 1/20 0.41
GRM5 P41594 1/20 0.41
NAPRT Q6XQN6 1/20 0.40
P4HTM Q9NXG6 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CHRM2 P08172 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
DRD1 P21728 1/20 0.40
SLC6A2 P23975 1/20 0.40

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
Acetic Acid SCHEMBL9792689 0.85 ALDH1A1 (0.48) POLQPOLBLMNACYP2D6CYP2C19
Trifluoroacetic Acid SCHEMBL28883710 0.84 POLB (0.46) POLQPOLBLMNACYP2D6CYP2C19
SCHEMBL14695633 0.81 POLQ (0.40) POLQPOLBLMNAMDM2CYP2D6
SCHEMBL364 0.81
SCHEMBL29635663 0.81
Trifluoroacetic Acid SCHEMBL838129 0.81 PPARG (0.46) POLQPOLBLMNACYP2D6CYP2C19
SCHEMBL10607816 0.79 POLB (0.50) POLQPOLBLMNACYP2D6CYP2C19
Bromide SCHEMBL3252964 0.79 CYP2D6 (0.55) POLBLMNAMDM2CYP2D6CYP2C19
Bromide SCHEMBL20591841 0.79 CYP2D6 (0.55) POLBLMNAMDM2CYP2D6CYP2C19
Hydrochloric Acid SCHEMBL3529241 0.79 CYP2D6 (0.55) POLBLMNAMDM2CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4073063-A1 HETEROCYCLIC COMPOUNDS AS MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2022-10-19 EP disclosed
EP-0640068-B1 SYNTHESIS OF COSMETIC INGREDIENT UNILEVER PLC (GB) 2000-03-08 EP disclosed
US-5451691-A Synthesis of cosmetic ingredients ELIZABETH ARDEN, CO., DIVISION OF CONOPCO, INC. (US) 1995-09-19 US disclosed
EP-0640068-A1 SYNTHESIS OF COSMETIC INGREDIENT UNILEVER PLC (GB) 1995-03-01 EP disclosed
WO-1993022281-A1 SYNTHESIS OF COSMETIC INGREDIENT UNILEVER PLC (GB) 1993-11-11 WO disclosed