Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4776417

NC1CCC(C(=O)Nc2ccc(Oc3ccnc4[nH]ccc34)c(F)c2)C1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 18/20 0.56
FLT3 P36888 2/20 0.51
EGFR P00533 1/20 0.51
PDGFRB P09619 1/20 0.51
KIT P10721 1/20 0.51
KDR P35968 1/20 0.51
ROCK2 O75116 1/20 0.50

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
SCHEMBL8286892 0.95 MET (0.61) METFLT3KDRROCK2
Hydrochloric Acid SCHEMBL4773711 0.94 MET (0.60) METFLT3KDRROCK2
SCHEMBL4940558 0.85 MET (0.59) METFLT3
SCHEMBL8288991 0.82 MET (0.65) METFLT3KDRROCK2
SCHEMBL4769899 0.82 MET (0.53) METFLT3EGFRPDGFRBKIT
SCHEMBL8288936 0.81 MET (0.54) METFLT3EGFRPDGFRBKIT
SCHEMBL4822805 0.80 MET (0.67) METFLT3KDRROCK2
SCHEMBL4775389 0.79 MET (0.71) METFLT3EGFRPDGFRBKIT
SCHEMBL14028130 0.77 MET (0.56) METFLT3
SCHEMBL4769553 0.76 MET (0.61) METFLT3KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1709043-B1 PYRROLOPYRIDINE-SUBSTITUTED BENZOL DERIVATIVES FOR TREATING CARDIOVASCULAR DISEASES BAYER HEALTHCARE AG (DE) 2008-12-03 EP disclosed
EP-1709043-A1 PYRROLOPYRIDINE-SUBSTITUTED BENZOL DERIVATIVES FOR TREATING CARDIOVASCULAR DISEASES Bayer HealthCare AG (DE) 2006-10-11 EP disclosed
WO-2005058891-A1 PYRROLOPYRIDINE-SUBSTITUTED BENZOL DERIVATIVES FOR TREATING CARDIOVASCULAR DISEASES BAYER HEALTHCARE AG (DE) 2005-06-30 WO disclosed