Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL22587774

CC(=O)N1CCN(C2CCNCC2)c2ccccc21.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 7/20 0.44
▸ BRD4 O60885 2/20 0.42
▸ HTR2C P28335 3/20 0.41
▸ HTR2B P41595 2/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ NOTUM Q6P988 6/20 0.39
▸ CACNA1B Q00975 1/20 0.39

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
SCHEMBL22605561 0.91 GPBAR1 (0.50) GPBAR1BRD4HTR2CHTR2BHTR2A
SCHEMBL15933941 0.82 GPBAR1 (0.59) GPBAR1BRD4NOTUM
SCHEMBL8484580 0.78 HTR2C (0.48) GPBAR1HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL6246336 0.77 HTR2C (0.64) HTR2CHTR2BHTR2ANOTUM
SCHEMBL22588234 0.74 GPR119 (0.50) GPBAR1
SCHEMBL22605563 0.73 HRH3 (0.47) —
SCHEMBL1908589 0.72 NOTUM (0.53) BRD4NOTUM
SCHEMBL28533101 0.70 GPBAR1 (0.39) GPBAR1BRD4NOTUM
SCHEMBL27988819 0.70 GPBAR1 (0.54) GPBAR1
Trifluoroacetic Acid SCHEMBL30124615 0.69 KDM5A (0.40) HTR2CHTR2ACACNA1B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230099441-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME GENEROS BIOPHARMA LTD. (CN) 2023-03-30 — — US disclosed
WO-2020216378-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME 健艾仕生物医药有限公司 2020-10-29 — — WO 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-20230099441-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME STAT5A, STAT5B, JAK2 GPBAR1 3268/4885BRD4 257/4885HTR2C 2202/4885

“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.

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