Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30746019

Fc1cc(C2=CCNCC2)ccc1-c1nnc(-c2ccc(C3=CCNCC3)cc2F)n1C1CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.39
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
QDPR P09417 3/20 0.39
HTR2C P28335 4/20 0.38
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
KHK P50053 3/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
TBK1 Q9UHD2 1/20 0.35
CDK4 P11802 2/20 0.35
CDK6 Q00534 2/20 0.35
SIGMAR1 Q99720 1/20 0.35
SCN9A Q15858 1/20 0.35

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
SCHEMBL27007953 0.91 HTR2C (0.43) ALOX5APFEN1QDPRHTR2CKHK
Trifluoroacetic Acid SCHEMBL30745988 0.89 QDPR (0.43) P2RY14QDPRHTR2CKHKTBK1
SCHEMBL27025846 0.87 HTR2C (0.42) ALOX5APFEN1QDPRHTR2CKHK
Trifluoroacetic Acid SCHEMBL27134405 0.86 P2RY14 (0.41) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL27135947 0.84 CDK4 (0.42) P2RY14QDPRHTR2CTBK1CDK4
Trifluoroacetic Acid SCHEMBL27126926 0.83 ALOX5AP (0.41) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL30746015 0.83 ALOX5AP (0.41) P2RY14ALOX5APFEN1QDPRHTR2C
Trifluoroacetic Acid SCHEMBL30745992 0.83 P2RY14 (0.41) P2RY14ALOX5APFEN1QDPRHTR2C
SCHEMBL27025859 0.83 HTR2C (0.39) ALOX5APFEN1QDPRHTR2CKHK
Trifluoroacetic Acid SCHEMBL30745994 0.82 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.