Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30745982

Fc1cc(C2=CCNCC2)ccc1-c1nnc(-c2ccc(C3=CCNCC3)cc2F)o1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
QDPR P09417 3/20 0.43
P2RY14 Q15391 1/20 0.43
HTR2C P28335 7/20 0.43
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43
TBK1 Q9UHD2 1/20 0.43
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
SIGMAR1 Q99720 2/20 0.40
CCNT1 O60563 2/20 0.39
CDK9 P50750 2/20 0.39
SCN9A Q15858 1/20 0.38
FTO Q9C0B1 1/20 0.37

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
Trifluoroacetic Acid SCHEMBL30746008 0.98 P2RY14 (0.42) QDPRP2RY14HTR2CALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30746012 0.91 CCNT1 (0.40) QDPRP2RY14HTR2CALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30746002 0.91 ALOX5AP (0.45) QDPRP2RY14HTR2CALOX5APFEN1
SCHEMBL27007924 0.89 HTR2C (0.50) QDPRHTR2CALOX5APFEN1TBK1
SCHEMBL27007732 0.87 HTR2C (0.48) QDPRHTR2CALOX5APFEN1SIGMAR1
Trifluoroacetic Acid SCHEMBL30746013 0.86 PDE3B (0.50) QDPRP2RY14HTR2CALOX5APFEN1
Trifluoroacetic Acid SCHEMBL27134405 0.83 P2RY14 (0.41) QDPRP2RY14HTR2CALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30746019 0.81 P2RY14 (0.39) QDPRP2RY14HTR2CALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30745992 0.81 P2RY14 (0.41) QDPRP2RY14HTR2CALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30746015 0.81 ALOX5AP (0.41) QDPRP2RY14HTR2CALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018121-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMCIAL DIVERSITY CENTER, INC. (US) 2024-01-18 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-20240018121-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE ERG28, CYP51A1, MANBA QDPR 1183/4885P2RY14 3799/4885HTR2C 4135/4885

“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.