Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4510433

CC(C)NC(=O)Cn1c(-c2ccccc2)c(CN2CCC(c3c(Cl)cccc3Cl)CC2)c2ccccc21.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 5/20 0.41
AVPR1B P47901 2/20 0.39
TRPV4 Q9HBA0 4/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
TACR2 P21452 2/20 0.38
TACR3 P29371 2/20 0.38
TLR9 Q9NR96 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
KCNH2 Q12809 1/20 0.38
CACNA1C Q13936 1/20 0.38
SCN5A Q14524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
OPRL1 P41146 2/20 0.37
OPRM1 P35372 1/20 0.37
OPRK1 P41145 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
Trifluoroacetic Acid SCHEMBL4519828 0.87 KCNH2 (0.38) TRPV4TLR9TLR8TLR7KCNH2
SCHEMBL4514939 0.86 OPRL1 (0.45) TLR9TLR8TLR7OPRL1OPRM1
SCHEMBL4521637 0.86 AVPR1B (0.42) AVPR1BTRPV4ESR1ESR2TLR9
Trifluoroacetic Acid SCHEMBL5420943 0.85 HDAC6 (0.44) KCNH2HDAC2HDAC8HDAC6OPRL1
SCHEMBL4520660 0.83 TSHR (0.49) AVPR1B
Trifluoroacetic Acid SCHEMBL5419306 0.83 HDAC6 (0.43) KCNH2HDAC2HDAC8HDAC6
Trifluoroacetic Acid SCHEMBL5415360 0.83 HDAC6 (0.44) KCNH2HDAC2HDAC8HDAC6
Trifluoroacetic Acid SCHEMBL5423556 0.83 PAX8 (0.45) HDAC2HDAC8HDAC6OPRL1OPRM1
Trifluoroacetic Acid SCHEMBL5422830 0.83 LMNA (0.41) HDAC2HDAC8HDAC6
Trifluoroacetic Acid SCHEMBL5417447 0.82 BCHE (0.43) ESR1ESR2TACR2HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US claimed
EP-1841755-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2007-10-10 EP claimed
WO-2006070001-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2006-07-06 WO claimed
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US disclosed
EP-1841755-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2007-10-10 EP disclosed
WO-2006070001-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2006-07-06 WO 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-20090275555-A1 Substituted indole ligands for the ORL-1 receptor OGFRL1, OPRL1, ORMDL3 AVPR1A 78/4885AVPR1B 183/4885TRPV4 766/4885

“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.