Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1748997

COc1cc2c(-c3cc4cccnc4[nH]3)cn(CCCN3CCCN(C)CC3)c2cc1OC.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.53
SYK P43405 1/20 0.40
RIPK1 Q13546 2/20 0.39
KDR P35968 3/20 0.39
GSK3B P49841 1/20 0.39
DRD2 P14416 2/20 0.38
DRD3 P35462 2/20 0.38
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
EHMT2 Q96KQ7 4/20 0.36
EHMT1 Q9H9B1 3/20 0.36
EGFR P00533 2/20 0.35
DNMT1 P26358 1/20 0.35
MET P08581 1/20 0.35
NUDT1 P36639 1/20 0.35
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
TLR8 Q9NR97 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL1748879 0.93 IGF1R (0.61) IGF1RSYKRIPK1KDRGSK3B
Trifluoroacetic Acid SCHEMBL1748780 0.92 IGF1R (0.55) IGF1RSYKRIPK1KDRGSK3B
SCHEMBL1748413 0.88 IGF1R (0.63) IGF1RSYKRIPK1KDRGSK3B
SCHEMBL1748781 0.88 IGF1R (0.55) IGF1RSYKRIPK1KDRGSK3B
SCHEMBL5797045 0.85 IGF1R (0.63) IGF1RSYKRIPK1KDRGSK3B
SCHEMBL1749006 0.85 IGF1R (0.67) IGF1RSYKRIPK1KDRGSK3B
SCHEMBL1748415 0.82 IGF1R (0.69) IGF1RSYKEHMT2EHMT1DNMT1
SCHEMBL27687971 0.82 IGF1R (0.61) IGF1RSYKRIPK1DRD2DRD3
Trifluoroacetic Acid SCHEMBL1748912 0.81 IGF1R (0.56) IGF1RSYKRIPK1KDRDRD2
SCHEMBL1748998 0.80 GSK3B (0.37) IGF1RKDRGSK3BEHMT2EHMT1

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
US-7968566-B2 Pyrrolo(2,3-b) pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2011-06-28 US disclosed
US-20090233956-A1 NOVEL PYRROLO(2,3-b) PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2009-09-17 US disclosed
US-7528147-B2 Pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2009-05-05 US disclosed
US-20070093480-A1 Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors AVENTIS PHARMA S.A. (FR) 2007-04-26 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-20090233956-A1 NOVEL PYRROLO(2,3-b) PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS MAP3K19, MAP4K2, MAP3K1 IGF1R 817/4885SYK 379/4885RIPK1 392/4885
US-20070093480-A1 Novel pyrrolo (2,3-b)pyridine derivatives, the preparation and the pharmaceutical use thereof in the form of kinase inhibitors MAP3K19, MAP4K2, MAP3K1 IGF1R 817/4885SYK 379/4885RIPK1 392/4885

“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.