Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2085446

CCOc1ccc(CN)nc1F.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.35
USP2 O75604 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTR2C P28335 2/20 0.35
GLA P06280 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
CREBBP Q92793 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL2086359 0.87 AOC3 (0.42) CYP1A2CYP2C19NPC1USP2RAB9A
SCHEMBL29561785 0.73 KMT2A (0.43) DPP4NPC1USP2RAB9ASMN1; SMN2
SCHEMBL21060577 0.73 KMT2A (0.43) DPP4NPC1USP2RAB9ASMN1; SMN2
SCHEMBL2085198 0.71 CCR1 (0.39) CYP1A2CYP2C9CYP2C19SMN1; SMN2HSD17B10
SCHEMBL18132257 0.69 HDAC4 (0.47) CYP1A2CYP2C9CYP2C19NPC1L3MBTL1
Trifluoroacetic Acid SCHEMBL5389154 0.68 AGPAT2 (0.60) HTR2C
SCHEMBL2492253 0.66 TSHR (0.44) CYP2C19NPC1USP2RAB9ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL2086389 0.66 MAPK1 (0.50) NPC1RAB9AL3MBTL1TSHRALDH1A1
SCHEMBL2085154 0.66 KDM4E (0.43) CYP1A2CYP2C19NPC1RAB9ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL2081865 0.65 L3MBTL1 (0.49) CYP1A2CYP2C9CYP2C19HSD17B10L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7863269-B2 protease-activated receptor 1 (PAR1) inhibitors such as 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-(3-iminoimidazo[1,5-a]pyridin-2-yl)ethanone, used as anticoagulants SANOFI-AVENTIS (FR) 2011-01-04 US disclosed
EP-2054412-B1 IMINO-IMIDAZO-PYRIDINE DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY SANOFI AVENTIS (FR) 2009-12-02 EP disclosed
US-20090192150-A1 IMINO-IMIDAZO-PYRIDINE DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2009-07-30 US disclosed
EP-2054412-A2 IMINO-IMIDAZO-PYRIDINE DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY Sanofi-Aventis (FR) 2009-05-06 EP disclosed
WO-2008014888-A2 IMINO-IMIDAZO-PYRIDINE DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2008-02-07 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-20090192150-A1 IMINO-IMIDAZO-PYRIDINE DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY F2R, TFPI, F2RL1 DPP4 134/4885RXRA 2225/4885RXRB 2556/4885

“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.