Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4099614

COc1ccc(-c2cnn(-c3ccnc4[nH]ccc34)c2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.48
MET P08581 7/20 0.45
GRM4 Q14833 1/20 0.43
MAPKAPK2 P49137 1/20 0.43
CIT O14578 1/20 0.42
EGLN1 Q9GZT9 1/20 0.41
ABL1 P00519 2/20 0.40
BCR P11274 2/20 0.40
CCNK O75909 2/20 0.39
CDK12 Q9NYV4 2/20 0.39
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
INCENP Q9NQS7 1/20 0.39
TPX2 Q9ULW0 1/20 0.39
PRKCA P17252 1/20 0.38
PRKCE Q02156 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
SCHEMBL103041 0.90 PRKCI (0.58) PRKCIMETGRM4MAPKAPK2CIT
SCHEMBL29540955 0.90 PRKCI (0.58) PRKCIMETGRM4MAPKAPK2CIT
SCHEMBL4082709 0.88 PRKCI (0.52) PRKCIMETGRM4AURKAAURKB
Trifluoroacetic Acid SCHEMBL4082707 0.88 PRKCI (0.52) PRKCIGRM4CITAURKAAURKB
Trifluoroacetic Acid SCHEMBL4082067 0.88 PRKCI (0.54) PRKCIGRM4ABL1BCRAURKA
Trifluoroacetic Acid SCHEMBL4095594 0.87 PRKCI (0.51) PRKCIGRM4CITAURKAAURKB
Trifluoroacetic Acid SCHEMBL4094741 0.86 PRKCI (0.44) PRKCIGRM4AURKAAURKB
Trifluoroacetic Acid SCHEMBL4086835 0.85 PRKCI (0.48) PRKCIGRM4AURKAAURKBINCENP
Trifluoroacetic Acid SCHEMBL4087921 0.84 PRKCI (0.47) PRKCIGRM4AURKAAURKBINCENP
Trifluoroacetic Acid SCHEMBL4088476 0.83 CDK8 (0.47) PRKCIGRM4ABL1BCR

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
US-20130137681-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2013-05-30 US disclosed
US-8415362-B2 Pyrazolyl substituted pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE CORPORATION (US) 2013-04-09 US disclosed
US-20090181959-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-07-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130137681-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 PRKCI 304/4885MET 1680/4885GRM4 2958/4885
US-20090181959-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 PRKCI 304/4885MET 1680/4885GRM4 2958/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.