Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30746012

CNc1cc(C2=CCNCC2)ccc1-c1nnc(-c2ccc(C3=CCNCC3)cc2F)o1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 4/20 0.40
CDK9 P50750 4/20 0.40
P2RY14 Q15391 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
TBK1 Q9UHD2 1/20 0.38
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
QDPR P09417 3/20 0.37
HTR2C P28335 4/20 0.36
FTO Q9C0B1 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
CSF1R P07333 1/20 0.36
BTK Q06187 1/20 0.35
KHK P50053 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
SCHEMBL27007694 0.91 HTR2C (0.41) CCNT1CDK9ALOX5APFEN1QDPR
Trifluoroacetic Acid SCHEMBL30745982 0.91 QDPR (0.43) CCNT1CDK9P2RY14ALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30746008 0.89 P2RY14 (0.42) CCNT1CDK9P2RY14ALOX5APFEN1
SCHEMBL27007739 0.85 QDPR (0.46) CCNT1CDK9TBK1CTSLCTSB
Trifluoroacetic Acid SCHEMBL30746002 0.83 ALOX5AP (0.45) CCNT1CDK9P2RY14ALOX5APFEN1
SCHEMBL27007924 0.82 HTR2C (0.50) ALOX5APFEN1TBK1QDPRHTR2C
SCHEMBL27007732 0.80 HTR2C (0.48) ALOX5APFEN1QDPRHTR2CKHK
Trifluoroacetic Acid SCHEMBL30746013 0.79 PDE3B (0.50) P2RY14ALOX5APFEN1TBK1QDPR
Trifluoroacetic Acid SCHEMBL27134405 0.78 P2RY14 (0.41) CCNT1CDK9P2RY14ALOX5APFEN1
Trifluoroacetic Acid SCHEMBL30745986 0.77 CCNT1 (0.38) CCNT1CDK9P2RY14CTSLCTSB

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 CCNT1 2408/4885CDK9 872/4885P2RY14 3799/4885

“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.