Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30745992

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.OCCn1c(-c2ccc(C3=CCNCC3)cc2F)nnc1-c1ccc(C2=CCNCC2)cc1F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.41
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
QDPR P09417 3/20 0.38
HTR2C P28335 5/20 0.38
CCNT1 O60563 2/20 0.35
CDK9 P50750 2/20 0.35
KHK P50053 3/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
SCN9A Q15858 1/20 0.35
SIGMAR1 Q99720 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
Trifluoroacetic Acid SCHEMBL30746015 0.92 ALOX5AP (0.41) P2RY14ALOX5APFEN1QDPRHTR2C
SCHEMBL27026011 0.92 QDPR (0.42) ALOX5APFEN1QDPRHTR2CKHK
SCHEMBL27007871 0.92 QDPR (0.44) ALOX5APFEN1QDPRHTR2CKHK
Hydrochloric Acid SCHEMBL27007883 0.91 QDPR (0.41) ALOX5APFEN1QDPRHTR2CKHK
Trifluoroacetic Acid SCHEMBL27128175 0.89 QDPR (0.39) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL27127184 0.89 QDPR (0.43) P2RY14QDPRHTR2CKHKSCN9A
Trifluoroacetic Acid SCHEMBL27134405 0.87 P2RY14 (0.41) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL30745994 0.87 BRD4 (0.43) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL27148687 0.87 QDPR (0.37) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL30745990 0.86 BRD4 (0.43) P2RY14ALOX5APFEN1QDPRHTR2C

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 P2RY14 3799/4885ALOX5AP 1911/4885FEN1 976/4885

“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.