Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30745977

Cn1c(-c2ccc(C3=CCNC3)cc2)nnc1-c1ccc(C2=CCNC2)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.38
ALDH1A1 P00352 4/20 0.35
CHRNA7 P36544 1/20 0.33
P2RY14 Q15391 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
QDPR P09417 1/20 0.32
DGAT1 O75907 1/20 0.32

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
SCHEMBL27008011 0.87 HSD11B1 (0.37) HSD11B1ALDH1A1SMN1; SMN2QDPR
Trifluoroacetic Acid SCHEMBL30745974 0.86 HSD11B1 (0.38) HSD11B1DGAT1
Trifluoroacetic Acid SCHEMBL30745997 0.80 P2RY14 (0.41) HSD11B1P2RY14QDPR
SCHEMBL27007675 0.79 HSD11B1 (0.43) HSD11B1
Trifluoroacetic Acid SCHEMBL22638772 0.79 P2RY14 (0.47) P2RY14QDPR
Trifluoroacetic Acid SCHEMBL27134405 0.79 P2RY14 (0.41) P2RY14QDPR
Trifluoroacetic Acid SCHEMBL30746006 0.78 PDE3B (0.51) HSD11B1P2RY14QDPRDGAT1
Trifluoroacetic Acid SCHEMBL27126926 0.77 ALOX5AP (0.41) P2RY14QDPR
Trifluoroacetic Acid SCHEMBL30745986 0.74 CCNT1 (0.38) P2RY14QDPR
Trifluoroacetic Acid SCHEMBL27127184 0.74 QDPR (0.43) P2RY14QDPR

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 HSD11B1 185/4885ALDH1A1 1109/4885CHRNA7 4829/4885

“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.