Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5474127

CCN1CCN(S(=O)(=O)c2ccc(Cl)c(-n3c(=O)[nH]c4ccccc4c3=O)c2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 2/20 0.45
APOBEC3G Q9HC16 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
PKM P14618 1/20 0.44
CXCR2 P25025 1/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
GNRHR P30968 4/20 0.43
TSHR P16473 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.41
TP53 P04637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL14597072 0.92 TSHR (0.48) APOBEC3AAPOBEC3GNPC1RAB9APKM
Trifluoroacetic Acid SCHEMBL5469149 0.84 RAB9A (0.53) RAB9APKMTSHRKDM4EHTT
SCHEMBL5469944 0.77 MEN1 (0.54) GNRHRTSHRKDM4EHTTKMT2A
SCHEMBL5474130 0.77 PKM (0.43) APOBEC3AAPOBEC3GNPC1RAB9APKM
Trifluoroacetic Acid SCHEMBL5472885 0.77 KDM4E (0.39) NPC1GNRHRKDM4EHTTKMT2A
Trifluoroacetic Acid SCHEMBL5461737 0.76 GNRHR (0.40) NPC1PKMGNRHRKDM4EHTT
Trifluoroacetic Acid SCHEMBL5461048 0.75 GNRHR (0.44) PKMGNRHRKDM4EHTTTP53
SCHEMBL5461553 0.75 GNRHR (0.51) GNRHRKDM4EHTTKMT2ATP53
SCHEMBL5470082 0.73 RXFP1 (0.53) PKMGNRHRTSHRKDM4EHTT
Trifluoroacetic Acid SCHEMBL5472760 0.73 MAPT (0.42) TSHRKDM4EKMT2ATP53ALDH1A1

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-20070010537-A1 Fused pyramidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
EP-1657238-A1 FUSED PYRIMIDINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-05-17 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-20070010537-A1 Fused pyramidine derivative and use thereof NR5A1, GNRHR, RXFP3 APOBEC3A 2160/4885APOBEC3G 3648/4885NPC1 4313/4885

“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.