Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30745997

Cc1cc(C2=CCNCC2)ccc1-c1nnc(-c2ccc(C3=CCNCC3)cc2)n1C.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.41
QDPR P09417 3/20 0.41
HTR2C P28335 4/20 0.40
KHK P50053 6/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
SIGMAR1 Q99720 2/20 0.37
HSD11B1 P28845 1/20 0.36
SOS1 Q07889 1/20 0.36
TGFBR1 P36897 1/20 0.36
ACVR1 Q04771 1/20 0.36
KCNH2 Q12809 1/20 0.36

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 SCHEMBL27134405 0.91 P2RY14 (0.41) P2RY14QDPRHTR2CKHKPDE3B
SCHEMBL27007764 0.90 QDPR (0.46) QDPRHTR2CKHKSIGMAR1HSD11B1
Trifluoroacetic Acid SCHEMBL27126926 0.88 ALOX5AP (0.41) P2RY14QDPRHTR2CKHKPDE3B
SCHEMBL27025885 0.88 QDPR (0.48) QDPRHTR2CKHKSIGMAR1TGFBR1
Trifluoroacetic Acid SCHEMBL30746006 0.88 PDE3B (0.51) P2RY14QDPRHTR2CKHKPDE3B
SCHEMBL27026001 0.81 HTR2C (0.44) QDPRHTR2CKHKSIGMAR1TGFBR1
SCHEMBL27025891 0.81 HTR2C (0.44) QDPRHTR2CKHKPDE3BPDE3A
Trifluoroacetic Acid SCHEMBL30745996 0.81 WDR5 (0.43) P2RY14HTR2CSOS1
SCHEMBL27007805 0.81 PDE3B (0.53) P2RY14QDPRHTR2CKHKPDE3B
Trifluoroacetic Acid SCHEMBL30745977 0.80 HSD11B1 (0.38) P2RY14QDPRHSD11B1

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 3799/4885QDPR 1183/4885HTR2C 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.