Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29958833

O=C(O)C(F)(F)F.O=C(O)CNc1ccncc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.45
PLOD2 O00469 1/20 0.45
PLOD3 O60568 1/20 0.45
PLOD1 Q02809 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
UBE2N P61088 1/20 0.43
GRK2 P25098 3/20 0.41
ROCK2 O75116 1/20 0.41
MDM2 Q00987 1/20 0.41
TAAR1 Q96RJ0 2/20 0.41
FFAR1 O14842 1/20 0.40
FDPS P14324 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
JAK2 O60674 1/20 0.39
TYK2 P29597 1/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.37
NAMPT P43490 1/20 0.37

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
SCHEMBL7723775 0.89 BCHE (0.53) BCHEPLOD2PLOD3PLOD1L3MBTL1
Trifluoroacetic Acid SCHEMBL27535061 0.79 FFAR1 (0.50) L3MBTL1FFAR1MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL15778253 0.79 ROCK2 (0.49) BCHEGRK2ROCK2FFAR1
SCHEMBL951015 0.77 FFAR1 (0.58) L3MBTL1FFAR1MEN1KMT2ALMNA
SCHEMBL11481061 0.75 MDM2 (0.52) BCHEL3MBTL1GRK2ROCK2MDM2
SCHEMBL5692310 0.74 ALDH1A1 (0.44) FFAR1MEN1KMT2ALMNA
Trifluoroacetic Acid SCHEMBL4535893 0.74 PORCN (0.57) GRK2ROCK2MEN1KMT2ALMNA
SCHEMBL3197308 0.74 BCHE (0.59) BCHEL3MBTL1MDM2TAAR1FFAR1
Trifluoroacetic Acid SCHEMBL28175119 0.74 ALDH1A1 (0.45) BCHEPLOD2PLOD3PLOD1L3MBTL1
SCHEMBL5167269 0.72 MDM2 (0.48) BCHEL3MBTL1GRK2ROCK2MDM2

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-4308122-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-01-24 EP disclosed
WO-2022194779-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2022-09-22 WO disclosed