Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6202229

Cc1cc(C(=O)N2CCCCc3sccc32)ccc1CNC(=O)N1CCC(=S)[C@H]1C(=O)N1CCCN(C)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 19/20 0.67
OXTR P30559 10/20 0.67
AVPR1A P37288 2/20 0.47
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM3 P20309 1/20 0.43
DRD3 P35462 1/20 0.43
OPRK1 P41145 1/20 0.43

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
SCHEMBL1662737 0.95 AVPR2 (0.73) AVPR2OXTRAVPR1ACHRM2CHRM4
SCHEMBL5435288 0.83 AVPR2 (0.88) AVPR2OXTRAVPR1ACHRM2CHRM4
SCHEMBL45247 0.79 OXTR (0.59) AVPR2OXTRAVPR1ACHRM2CHRM4
Trifluoroacetic Acid SCHEMBL6202890 0.78 AVPR2 (0.62) AVPR2OXTRAVPR1ACHRM2CHRM4
SCHEMBL38603 0.76 AVPR2 (0.58) AVPR2OXTRAVPR1A
SCHEMBL6202233 0.76 AVPR2 (0.67) AVPR2OXTRAVPR1A
SCHEMBL1660631 0.74 OXTR (0.76) AVPR2OXTRAVPR1ACHRM2CHRM4
SCHEMBL8368994 0.73 AVPR2 (0.61) AVPR2OXTRAVPR1A
SCHEMBL4835899 0.73 AVPR2 (0.60) AVPR2OXTR
Hydrochloric Acid SCHEMBL4828748 0.72 AVPR2 (0.61) AVPR2OXTRAVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1399436-B1 OXYTOCIN AGONISTS FERRING BV (NL) 2005-03-16 EP disclosed
US-20040235753-A1 Oxytocin agonists PITT GRAY ROBERT WILLIAM (GB) 2004-11-25 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 (1 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-20040235753-A1 Oxytocin agonists OXTR, GNRHR, PRLHR AVPR2 10/4885OXTR 1/4885AVPR1A 7/4885

“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.