Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7830252

Cc1cccc(CC2(C#N)CCN(Cc3cnc(C)n3Cc3ccc(C#N)cc3)CC2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.54
FNTB P49356 5/20 0.54
PGGT1B P53609 5/20 0.54
USP2 O75604 5/20 0.40
CYP2D6 P10635 5/20 0.40
CYP3A4 P08684 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
CYP1A2 P05177 3/20 0.39
TSHR P16473 3/20 0.39
CYP2C9 P11712 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 2/20 0.39
HIF1A Q16665 1/20 0.39
HPGD P15428 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL7843579 0.92 FNTA (0.53) FNTAFNTBPGGT1BUSP2CYP2D6
Trifluoroacetic Acid SCHEMBL7841379 0.90 FNTA (0.53) FNTAFNTBPGGT1BUSP2CYP2D6
SCHEMBL7960947 0.84 FNTA (0.56) FNTAFNTBPGGT1BUSP2CYP2D6
Trifluoroacetic Acid SCHEMBL7850384 0.83 FNTA (0.56) FNTAFNTBPGGT1BUSP2CYP2D6
SCHEMBL7839865 0.82 FNTA (0.53) FNTAFNTBPGGT1BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL7972327 0.81 FNTA (0.53) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL7837600 0.80 FNTA (0.52) FNTAFNTBPGGT1BUSP2CYP3A4
SCHEMBL7840536 0.79 FNTA (0.54) FNTAFNTBPGGT1BCYP3A4MEN1
Trifluoroacetic Acid SCHEMBL7976927 0.79 FNTA (0.54) FNTAFNTBPGGT1B
Trifluoroacetic Acid SCHEMBL7972325 0.77 FNTA (0.47) FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807112-B1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 2001-09-05 EP disclosed
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
US-6124334-A A BACTERICIDE TREATING INFECTIONS CAUSED BY GRAM-POSITIVE AEROBIC BACTERIA SUCH AS STAPHYLOCOCCUS, STREPTOCOCCUS AND ENTEROCOCCUS AS WELL AS ANAEROBIC ORGANISMS SUCH AS BACTEROIDES AND CLOSTRIDIUM AND MYCOBACTERIDIUM PHARMACIA & UPJOHN COMPANY (US) 2000-09-26 US disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
US-5910504-A BACTERICIDES TREATING INFECTIONS PHARMACIA & UPJOHN (US) 1999-06-08 US disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed
WO-1996023788-A1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA + UPJOHN COMPANY (US) 1996-08-08 WO disclosed