Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6433147

CCOC(=O)c1cc2cc(N)ccc2n1Cc1cccc(C#N)c1.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.54
F10 P00742 5/20 0.51
POLB P06746 2/20 0.48
CNR1 P21554 8/20 0.47
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
NOD2 Q9HC29 1/20 0.46
NOD1 Q9Y239 1/20 0.46
TSHR P16473 2/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.42
ATM Q13315 1/20 0.42
F2 P00734 1/20 0.42

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
Trifluoroacetic Acid SCHEMBL6436827 0.88 CCR2 (0.69) CCR2F10CNR1F2
SCHEMBL6436829 0.85 CCR2 (0.55) CCR2F10POLBCNR1F2
SCHEMBL6433615 0.84 CCR2 (0.58) CCR2F10POLBCNR1MAPT
Trifluoroacetic Acid SCHEMBL6433228 0.83 F10 (0.72) CCR2F10CNR1F2
SCHEMBL6432762 0.82 CCR2 (0.58) CCR2F10POLBCNR1MAPT
SCHEMBL6433289 0.82 NOD2 (0.67) CCR2F10POLBMAPTTDP1
SCHEMBL6433082 0.82 CCR2 (0.78) CCR2F10F2
Trifluoroacetic Acid SCHEMBL6436624 0.81 F10 (0.67) CCR2F10CNR1F2
SCHEMBL6439399 0.80 F10 (0.60) CCR2F10POLBCNR1MAPT
SCHEMBL6432920 0.77 F10 (0.67) CCR2F10POLBMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042287-B1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
US-6337344-B1 ANTICOAGULANTS AND ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-01-08 US disclosed
EP-1042287-A1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA Aventis Pharma Deutschland GmbH (DE) 2000-10-11 EP disclosed
WO-1999033800-A1 INDOLE DERIVATIVES AS INHIBITORS OR FACTOR XA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-08 WO disclosed