Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7251980

N[C@H]1CC=CC2CN(Cc3ccccc3)CCN2C1=O.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DPP7 Q9UHL4 2/20 0.38
▸ DPP4 P27487 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ PREP P48147 1/20 0.37
▸ TACR1 P25103 2/20 0.37
▸ DPP8 Q6V1X1 1/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA4 P22748 2/20 0.36
▸ CA9 Q16790 2/20 0.36

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
SCHEMBL7253237 0.91 TACR1 (0.42) SIGMAR1ALDH1A1TACR1
SCHEMBL7246639 0.78 FPR2 (0.43) DRD2DRD4SIGMAR1PREPTACR1
Trifluoroacetic Acid SCHEMBL19613522 0.72 DRD2 (0.49) DRD2DRD4SIGMAR1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL19613524 0.72 DRD2 (0.49) DRD2DRD4SIGMAR1KMT2AALDH1A1
SCHEMBL7543008 0.69 SIGMAR1 (0.45) LMNADRD4SIGMAR1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL9038823 0.67 S1PR5 (0.67) KMT2AMEN1
Trifluoroacetic Acid SCHEMBL2267986 0.67 SIGMAR1 (0.57) LMNASIGMAR1KMT2AALDH1A1MEN1
Trifluoroacetic Acid SCHEMBL2267982 0.67 SIGMAR1 (0.57) LMNASIGMAR1KMT2AALDH1A1MEN1
Trifluoroacetic Acid SCHEMBL2269036 0.66 ALDH1A1 (0.57) LMNADPP7SIGMAR1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL29977328 0.66 S1PR5 (0.48) LMNASIGMAR1KMT2AALDH1A1

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-6525044-B2 Treatment of neurological disorders related to beta -amyloid production such as Alzheimer's disease and Down's Syndrome. BRISTOL-MYERS SQUIBB COMPANY 2003-02-25 — — US disclosed
US-20020055501-A1 Succinoylamino carbocycles and heterocycles as inhibitors of a-beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-05-09 — — US 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-20020055501-A1 Succinoylamino carbocycles and heterocycles as inhibitors of a-beta protein production APP, APH1A, APH1B CPB2 402/4885LMNA 570/4885DRD2 3901/4885

“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.

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