Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1921565

NC1CCN(Cc2cccc(F)c2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.59
▸ UBE2M P61081 1/20 0.53
▸ DCUN1D1 Q96GG9 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ FAAH O00519 1/20 0.51
▸ KMT2A Q03164 3/20 0.50
▸ POLB P06746 2/20 0.50
▸ ACHE P22303 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ CACNA1G O43497 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ HPGD P15428 1/20 0.49

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
SCHEMBL6944257 0.88 ALDH1A1 (0.66) SIGMAR1ALDH1A1SMN1; SMN2KMT2APOLB
SCHEMBL30089449 0.88 ALDH1A1 (0.66) SIGMAR1ALDH1A1SMN1; SMN2KMT2APOLB
Trifluoroacetic Acid SCHEMBL1920766 0.84 SIGMAR1 (0.53) SIGMAR1
Trifluoroacetic Acid SCHEMBL1921350 0.81 MCHR1 (0.58) SIGMAR1FAAHKMT2AACHE
SCHEMBL1519149 0.80 SIGMAR1 (0.65) SIGMAR1ALDH1A1SMN1; SMN2FAAHKMT2A
SCHEMBL5360590 0.79 SIGMAR1 (0.60) SIGMAR1ALDH1A1SMN1; SMN2KMT2APOLB
Trifluoroacetic Acid SCHEMBL1920595 0.79 ARG1 (0.52) SIGMAR1ALDH1A1KMT2AMEN1
Trifluoroacetic Acid SCHEMBL19613522 0.79 DRD2 (0.49) SIGMAR1ALDH1A1KMT2AACHEMEN1
Trifluoroacetic Acid SCHEMBL19613524 0.79 DRD2 (0.49) SIGMAR1ALDH1A1KMT2AACHEMEN1
SCHEMBL18658336 0.79 SIGMAR1 (0.71) SIGMAR1UBE2MDCUN1D1ALDH1A1KMT2A

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 SIGMAR1 1187/4885UBE2M 4672/4885DCUN1D1 1527/4885

“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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