Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4103267

COc1ccc(C(=O)c2ccc(OCCc3c[nH]c4ccccc34)nc2)c(OC(C)(C)C(=O)O)c1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.47
CDK2 P24941 2/20 0.42
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
CDK4 P11802 3/20 0.41
CCND1 P24385 3/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
MTNR1A P48039 1/20 0.39
GPR84 Q9NQS5 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38

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
SCHEMBL4103273 0.91 TRPV1 (0.46) TRPV1CDK2NPC1POLBRAB9A
SCHEMBL4099708 0.88 TP53 (0.48) TRPV1CDK2NPC1POLBRAB9A
SCHEMBL4103465 0.82 PPARG (0.50) NPC1POLBMTNR1A
Trifluoroacetic Acid SCHEMBL4099601 0.82 PPARG (0.44) POLB
Trifluoroacetic Acid SCHEMBL4093275 0.82 PPARG (0.47)
Trifluoroacetic Acid SCHEMBL4105730 0.81 POLB (0.39) NPC1POLBRAB9ASMN1; SMN2CYP1A2
Trifluoroacetic Acid SCHEMBL4103434 0.81 PPARG (0.45) NPC1POLBRAB9ASMN1; SMN2CYP1A2
Trifluoroacetic Acid SCHEMBL4098182 0.81 PPARG (0.41) NPC1MEN1KMT2ASMN1; SMN2CYP3A4
Trifluoroacetic Acid SCHEMBL4103725 0.80 PPARA (0.40) NPC1POLBMEN1KMT2AMAPT
Trifluoroacetic Acid SCHEMBL4103491 0.80 POLB (0.42) NPC1POLBMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054435-A1 Phenoxyalkanoic Acid Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-26 US disclosed
EP-1911738-A1 PHENOXYALKANOIC ACID COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP 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-20090054435-A1 Phenoxyalkanoic Acid Compound PNLIP, GPR119, LIPC TRPV1 1163/4885CDK2 4720/4885NPC1 170/4885

“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.