Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3553129

COc1ccc2c(c1)C[C@@H]1CNCCN1C2=O.O=C(O)C(F)(F)F

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 20/20 0.82
HTR2B P41595 18/20 0.82
HTR2A P28223 17/20 0.82
HTR6 P50406 1/20 0.46

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 SCHEMBL3554179 0.92 HTR2C (0.82) HTR2CHTR2BHTR2AHTR6
SCHEMBL13119233 0.90 HTR2C (1.00) HTR2CHTR2BHTR2AHTR6
Trifluoroacetic Acid SCHEMBL3556794 0.86 HTR2C (0.80) HTR2CHTR2BHTR2A
SCHEMBL3552904 0.85 HTR2C (0.67) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL3552902 0.85 HTR2C (0.67) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL3556778 0.84 HTR2C (0.87) HTR2CHTR2BHTR2AHTR6
Trifluoroacetic Acid SCHEMBL3557461 0.84 HTR2C (0.80) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL3561669 0.84 HTR2C (0.65) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL3562919 0.84 HTR2C (0.62) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL3553405 0.84 HTR2C (0.82) HTR2CHTR2BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675859-B1 MODULATORS OF SEROTONIN RECEPTORS BRISTOL MYERS SQUIBB CO (US) 2012-12-05 EP claimed
US-20050080074-A1 Modulators of serotonin receptors BRISTOL-MYERS SQUIBB COMPANY 2005-04-14 US claimed
EP-1675859-B1 MODULATORS OF SEROTONIN RECEPTORS BRISTOL MYERS SQUIBB CO (US) 2012-12-05 EP disclosed
US-7812024-B2 Modulators of serotonin receptors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-10-12 US disclosed
US-20070213337-A1 MODULATORS OF SEROTONIN RECEPTORS BRISTOL-MYERS SQUIBB COMPANY 2007-09-13 US disclosed
US-7244843-B2 Modulators of serotonin receptors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-17 US disclosed
US-20050080074-A1 Modulators of serotonin receptors BRISTOL-MYERS SQUIBB COMPANY 2005-04-14 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 (2 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-20070213337-A1 MODULATORS OF SEROTONIN RECEPTORS HTR5A, HTR1A, HTR2A HTR2C 5/4885HTR2B 4/4885HTR2A 3/4885
US-20050080074-A1 Modulators of serotonin receptors HTR5A, HTR1A, HTR2B HTR2C 6/4885HTR2B 3/4885HTR2A 4/4885

“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.