Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29888481

NC(=O)c1ccoc1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP3A4 P08684 2/20 0.39
RECQL P46063 2/20 0.39
POLB P06746 1/20 0.39
PARP1 P09874 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TRPA1 O75762 1/20 0.38
KCNK3 O14649 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
TBK1 Q9UHD2 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
SCHEMBL826974 0.86
Hydrochloric Acid SCHEMBL28120372 0.84
SCHEMBL28094693 0.84
Terephthalamide SCHEMBL30182529 0.78 PARP1 (0.56) MAPTL3MBTL1CYP3A4RECQLPOLB
SCHEMBL8615758 0.76 CES1 (0.50) MAPTADORA2AADORA1CYP3A4RECQL
Trifluoroacetic Acid SCHEMBL28025668 0.75 HCAR2 (0.37) MAPTADORA2AADORA1L3MBTL1POLB
Benzamide SCHEMBL1786300 0.74 PARP1 (0.73) MAPTL3MBTL1CYP3A4RECQLPOLB
Benzamide SCHEMBL29494570 0.74 PARP1 (0.73) MAPTL3MBTL1CYP3A4RECQLPOLB
Benzamide SCHEMBL9005948 0.74 PARP1 (0.73) MAPTL3MBTL1CYP3A4RECQLPOLB
SCHEMBL30663307 0.74 TPMT (0.57) MAPTL3MBTL1CYP3A4RECQLPOLB

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
CN-114981251-B Dibenzofuran derivative cathepsin K inhibitor and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2023-11-21 CN disclosed
CN-114981251-A Diphenyl furan derivative cathepsin K inhibitor and preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-08-30 CN disclosed