Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6794419

CN1CCN(c2cc3c(cn2)CCc2c-3nn3c2C(=O)NCC3)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.36
HRH3 Q9Y5N1 2/20 0.36
PLK1 P53350 3/20 0.36
MAPKAPK2 P49137 3/20 0.35
IKBKB O14920 9/20 0.34
CHUK O15111 1/20 0.34
FLT3 P36888 1/20 0.34
PLK3 Q9H4B4 1/20 0.34
NEK6 Q9HC98 1/20 0.34
PLK2 Q9NYY3 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
TACR1 P25103 1/20 0.33
CREBBP Q92793 1/20 0.32

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 SCHEMBL4267636 0.92 AR (0.32) HRH4HRH3IKBKBCREBBP
Trifluoroacetic Acid SCHEMBL6794506 0.92 HRH4 (0.36) HRH4HRH3PLK1IKBKBFLT3
Trifluoroacetic Acid SCHEMBL6791878 0.90
Trifluoroacetic Acid SCHEMBL6792038 0.90 IKBKB (0.35) IKBKBSMN1; SMN2TACR1CREBBP
Trifluoroacetic Acid SCHEMBL4267055 0.90 IKBKB (0.35) IKBKBTACR1
Trifluoroacetic Acid SCHEMBL4262642 0.88 MAPKAPK2 (0.33) PLK1MAPKAPK2
Trifluoroacetic Acid SCHEMBL4270570 0.88
Trifluoroacetic Acid SCHEMBL6788114 0.86 RAB9A (0.33) IKBKBSMN1; SMN2CREBBP
Trifluoroacetic Acid SCHEMBL6794258 0.86 GRIN2D (0.38)
Trifluoroacetic Acid SCHEMBL6797574 0.84 CRBN (0.32)

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 HRH4 2096/4885HRH3 1936/4885PLK1 101/4885

“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.