Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6790792

C=CCNC(=O)NCCCn1nc2c(c1C(=O)O)CCc1cnccc1-2.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
PDPK1 O15530 1/20 0.30
CDK2 P24941 1/20 0.30
NAMPT P43490 1/20 0.30

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 SCHEMBL1658085 0.91 ALDH1A1 (0.31) KDM4EALDH1A1PKMHPGDPDPK1
Trifluoroacetic Acid SCHEMBL6792947 0.89 CYP1A2 (0.38) HPGDPDPK1CDK2NAMPT
SCHEMBL6790796 0.88 KDM4E (0.31) KDM4EALDH1A1PKMHPGD
Trifluoroacetic Acid SCHEMBL1655691 0.86 CDK2 (0.32) HPGDPDPK1CDK2NAMPT
Trifluoroacetic Acid SCHEMBL6795264 0.86 NPC1 (0.39) SMN1; SMN2NAMPT
Trifluoroacetic Acid SCHEMBL6791540 0.85 CYP1A2 (0.34) KDM4EHPGDPDPK1CDK2NAMPT
Trifluoroacetic Acid SCHEMBL6800586 0.85 NAMPT (0.44) ALDH1A1HPGDSMN1; SMN2NAMPT
Trifluoroacetic Acid SCHEMBL6793508 0.83 CDK4 (0.33) HPGDCDK2
Trifluoroacetic Acid SCHEMBL6793561 0.83 CDK2 (0.32) PDPK1CDK2
Trifluoroacetic Acid SCHEMBL6791633 0.83 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 US claimed

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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 KDM4E 2167/4885ALDH1A1 4449/4885PKM 383/4885

“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.