Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6460104

Cc1cc(N[C@H]2CC[C@@H](NC(=O)c3ccc(F)c(F)c3F)CC2)nc2ccccc12.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.60
ADRA2A P08913 4/20 0.60
LMNA P02545 2/20 0.51
KDM4E B2RXH2 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RXFP1 Q9HBX9 4/20 0.46
TP53 P04637 3/20 0.46
RAB9A P51151 2/20 0.45
MAPT P10636 4/20 0.45
HTR1A P08908 1/20 0.45
ADRA1A P35348 1/20 0.45
HRH1 P35367 1/20 0.45
HTR2B P41595 1/20 0.45
NPY5R Q15761 1/20 0.45
POLB P06746 1/20 0.43

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
SCHEMBL6456878 0.88 KDM4E (0.56) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6456870 0.88 KDM4E (0.56) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL6463158 0.87 KDM4E (0.55) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL6463163 0.87 KDM4E (0.55) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
Trifluoroacetic Acid SCHEMBL6462476 0.86 MCHR1 (0.61) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6465647 0.85 MCHR1 (0.63) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6465642 0.85 MCHR1 (0.63) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
Trifluoroacetic Acid SCHEMBL6460864 0.84 LMNA (0.54) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6463313 0.84 SMN1; SMN2 (0.56) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6463112 0.84 SMN1; SMN2 (0.56) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2

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 MCHR1 2/4885ADRA2A 117/4885LMNA 3391/4885

“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.