Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6467012

Cc1cc(CN[C@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)nc2ccccc12.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 4/20 0.48
MCHR1 Q99705 4/20 0.48
ADRA1A P35348 1/20 0.44
HRH1 P35367 1/20 0.44
CRHR1 P34998 1/20 0.44
BRD4 O60885 2/20 0.42
TACR1 P25103 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.40
RAB9A P51151 1/20 0.40
USP2 O75604 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
DRD4 P21917 1/20 0.39

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
SCHEMBL6879281 0.81 MCHR1 (0.58) ADRA2AMCHR1ADRA1AHRH1RXFP1
SCHEMBL6879276 0.81 MCHR1 (0.58) ADRA2AMCHR1ADRA1AHRH1RXFP1
SCHEMBL6467015 0.81 TACR1 (0.39) ADRA2AMCHR1TACR1RXFP1USP2
SCHEMBL6867248 0.81 ADRA2A (0.57) ADRA2AMCHR1ADRA1AHRH1CRHR1
SCHEMBL6867255 0.81 ADRA2A (0.57) ADRA2AMCHR1ADRA1AHRH1CRHR1
Hydrochloric Acid SCHEMBL6459511 0.81 ADRA2A (0.56) ADRA2AMCHR1ADRA1AHRH1CRHR1
Hydrochloric Acid SCHEMBL6459506 0.81 ADRA2A (0.56) ADRA2AMCHR1ADRA1AHRH1CRHR1
SCHEMBL6877394 0.80 MCHR1 (0.58) ADRA2AMCHR1CRHR1RAB9A
SCHEMBL6877400 0.80 MCHR1 (0.58) ADRA2AMCHR1CRHR1RAB9A
SCHEMBL6460123 0.74 ADRA2A (0.67) ADRA2AMCHR1ADRA1AHRH1CRHR1

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 ADRA2A 117/4885MCHR1 2/4885ADRA1A 209/4885

“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.