Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1920766

NC1CCN(Cc2ccc(F)cc2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.53
▸ HTR2A P28223 1/20 0.51
▸ DPP4 P27487 1/20 0.50
▸ DPP8 Q6V1X1 1/20 0.50
▸ SLC6A12 P48065 1/20 0.50
▸ TMEM97 Q5BJF2 1/20 0.50
▸ MCHR1 Q99705 1/20 0.50
▸ GRM2 Q14416 1/20 0.50

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 SCHEMBL1920595 0.89 ARG1 (0.52) SIGMAR1DPP4
SCHEMBL8108384 0.87 BCHE (0.55) HTR2A
SCHEMBL2852933 0.87 BCHE (0.55) HTR2A
Trifluoroacetic Acid SCHEMBL1920777 0.84 BCHE (0.56) —
Trifluoroacetic Acid SCHEMBL1921476 0.84 SIGMAR1 (0.55) SIGMAR1
Trifluoroacetic Acid SCHEMBL1921565 0.84 SIGMAR1 (0.59) SIGMAR1
Trifluoroacetic Acid SCHEMBL23853580 0.84 HRH3 (0.57) DPP8
Trifluoroacetic Acid SCHEMBL1921350 0.81 MCHR1 (0.58) SIGMAR1MCHR1
Trifluoroacetic Acid SCHEMBL19613524 0.81 DRD2 (0.49) SIGMAR1
Trifluoroacetic Acid SCHEMBL19613522 0.81 DRD2 (0.49) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622914-B1 NEW PIPERIDINYLAMINO-THIENO[2,3-D] PYRIMIDINE COMPOUNDS TROVIS PHARMACEUTICALS LLC (US) 2011-06-01 — — EP disclosed
CN-1777612-A New piperidinylamino-thieno[2,3-d] pyrimidine compounds PREDIX PHARMACEUTICALS HOLDING (US) 2006-05-24 — — CN disclosed
US-7030240-B2 5-HT receptor antagonist; [1-(2-Fluoro-benzyl)-piperidin-4-yl]-(5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidin-4-yl)-amine; treating vascular disorders, angina, migraine, pulmonary hypertension and systemic hypertension PREDIX PHARMACEUTICALS HOLDINGS, INC. (US) 2006-04-18 — — US disclosed
US-20040248904-A1 New piperidinylamino-thieno[2,3-d] pyrimidine compounds TROVIS PHARMACEUTICALS, LLC 2004-12-09 — — 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-20040248904-A1 New piperidinylamino-thieno[2,3-d] pyrimidine compounds HTR5A, HTR2C, HTR1A SIGMAR1 1187/4885HTR2A 4/4885DPP4 590/4885

“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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