Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2501043

CNc1nc(N)nc2c1oc1c(CCN)cc(Cl)cc12.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 7/20 0.36
ADORA2A P29274 2/20 0.33
ADORA1 P30542 1/20 0.33
PTPN1 P18031 2/20 0.32
HRH3 Q9Y5N1 1/20 0.31
SSTR2 P30874 1/20 0.30
SSTR4 P31391 1/20 0.30

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
SCHEMBL4345504 0.90 HRH4 (0.42) HRH4PTPN1HRH3SSTR2SSTR4
Trifluoroacetic Acid SCHEMBL2501172 0.87 HRH4 (0.35) HRH4ADORA2AADORA1SSTR2SSTR4
SCHEMBL603126 0.75 HRH4 (0.41) HRH4HRH3SSTR2SSTR4
Trifluoroacetic Acid SCHEMBL2493686 0.71 HRH4 (0.38) HRH4ADORA2AADORA1
Trifluoroacetic Acid SCHEMBL2498377 0.67 HRH4 (0.83) HRH4HRH3
Trifluoroacetic Acid SCHEMBL2493826 0.65 HRH4 (0.39) HRH4
Trifluoroacetic Acid SCHEMBL4528055 0.64 MAP4K4 (0.43) PTPN1
Trifluoroacetic Acid SCHEMBL2499846 0.64 HRH4 (0.81) HRH4
Trifluoroacetic Acid SCHEMBL3739182 0.61 PTPN1 (0.80) PTPN1
Trifluoroacetic Acid SCHEMBL4533732 0.61 PTPN1 (0.52) HRH4PTPN1

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-8030321-B2 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, NV (BE) 2011-10-04 US disclosed
US-20090325927-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor CHAVEZ FRANK 2009-12-31 US disclosed
US-7576092-B2 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA N.V. (BE) 2009-08-18 US disclosed
US-20080015200-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, N.V. (BE) 2008-01-17 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-20080015200-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor HRH4, HRH1, HRH2 HRH4 1/4885ADORA2A 643/4885ADORA1 356/4885
US-20090325927-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor HRH4, HRH1, HRH2 HRH4 1/4885ADORA2A 643/4885ADORA1 356/4885

“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.