Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3032309

CCC(=O)N(CC1CCNCC1)c1ccc2cc(OC)ccc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 9/20 0.40
EPHX2 P34913 1/20 0.40
OPRD1 P41143 1/20 0.40
MC4R P32245 1/20 0.40
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNH2 Q12809 1/20 0.37
HPGDS O60760 1/20 0.37
HTR4 Q13639 1/20 0.37

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
SCHEMBL3033983 0.93 ALDH1A1 (0.42) OPRM1MC4RKDM4EALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL3042529 0.88 OPRD1 (0.41) OPRD1HSD17B10SLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL3032574 0.87 CACNA1B (0.42) OPRM1OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL3033986 0.83 OPRM1 (0.49) OPRM1OPRD1KDM4EALDH1A1HTR4
Trifluoroacetic Acid SCHEMBL3029533 0.82 TACR1 (0.46) OPRD1SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL3039339 0.81 GHSR (0.47) KDM4EALDH1A1LMNAHPGDNPSR1
Trifluoroacetic Acid SCHEMBL3039321 0.81 OPRD1 (0.52) OPRM1OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL3041213 0.80 CACNA1B (0.46) OPRM1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL3035355 0.80 SLC6A4 (0.43) OPRM1OPRD1SLC6A2SLC6A4SLC6A3
SCHEMBL924001 0.76 MC4R (0.49) EPHX2OPRD1MC4RALDH1A1SLC6A2

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-20100204275-A1 N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2010-08-12 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-20100204275-A1 N-PIPERIDIN-4-YLMETHYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC18A3 OPRM1 55/4885EPHX2 1411/4885OPRD1 125/4885

“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.