Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6457569

Cc1cc(N[C@H]2CC[C@@H](NC(=O)Nc3cc(F)cc(F)c3)CC2)nc2ccccc12.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
EPHX1 P07099 1/20 0.41
MCHR1 Q99705 2/20 0.41
ADRA2A P08913 1/20 0.41
GPR6 P46095 3/20 0.41
RXFP1 Q9HBX9 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
Trifluoroacetic Acid SCHEMBL6467228 0.90 LMNA (0.51) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
Trifluoroacetic Acid SCHEMBL6460864 0.87 LMNA (0.54) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
Trifluoroacetic Acid SCHEMBL6461174 0.86 SMN1; SMN2 (0.49) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
Trifluoroacetic Acid SCHEMBL6458355 0.86 LMNA (0.49) KDM4ELMNASMN1; SMN2EPHX1MCHR1
Trifluoroacetic Acid SCHEMBL6457766 0.85 NPC1 (0.52) KDM4ELMNASMN1; SMN2MCHR1GPR6
Trifluoroacetic Acid SCHEMBL6464243 0.81 ADRA2A (0.61) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
Trifluoroacetic Acid SCHEMBL7133704 0.81 ADRA2A (0.61) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
SCHEMBL6458000 0.81 LMNA (0.59) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
SCHEMBL6458010 0.81 LMNA (0.59) KDM4ELMNASMN1; SMN2MCHR1ADRA2A
Hydrochloric Acid SCHEMBL6457804 0.81 LMNA (0.58) KDM4ELMNASMN1; SMN2MCHR1ADRA2A

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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 US disclosed
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 KDM4E 1190/4885LMNA 3391/4885SMN1; SMN2 1477/4885

“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.