Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1921350

NC1CCN(Cc2ccc3ccccc3c2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.58
SIGMAR1 Q99720 2/20 0.58
ACHE P22303 1/20 0.56
KMT2A Q03164 1/20 0.55
CAPN1 P07384 1/20 0.53
CCR3 P51677 4/20 0.52
FAAH O00519 1/20 0.51

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
SCHEMBL4834727 0.87 ACHE (0.72) MCHR1SIGMAR1ACHEKMT2A
Hydrochloric Acid SCHEMBL6306233 0.86 ACHE (0.70) MCHR1SIGMAR1ACHEKMT2A
Trifluoroacetic Acid SCHEMBL1921565 0.81 SIGMAR1 (0.59) SIGMAR1ACHEKMT2AFAAH
Trifluoroacetic Acid SCHEMBL1920595 0.81 ARG1 (0.52) SIGMAR1KMT2A
Trifluoroacetic Acid SCHEMBL1920766 0.81 SIGMAR1 (0.53) MCHR1SIGMAR1
SCHEMBL7304448 0.79 MCHR1 (0.65) MCHR1SIGMAR1ACHEKMT2ACAPN1
Trifluoroacetic Acid SCHEMBL1921476 0.79 SIGMAR1 (0.55) SIGMAR1ACHEKMT2A
Trifluoroacetic Acid SCHEMBL1920777 0.79 BCHE (0.56) ACHE
SCHEMBL4841995 0.79 ACHE (0.64) MCHR1SIGMAR1ACHEKMT2A
SCHEMBL2637536 0.79 ACHE (0.64) MCHR1SIGMAR1ACHEKMT2A

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 3 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
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 MCHR1 641/4885SIGMAR1 1187/4885ACHE 1151/4885

“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.