Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5451230

O=C(O)C(F)(F)F.c1ccc2c(c1)CCNCC2

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.61
PNMT P11086 1/20 0.50
CD44 P16070 1/20 0.50
MAOB P27338 1/20 0.50
KDM1A O60341 9/20 0.49
DRD2 P14416 2/20 0.46
DRD1 P21728 2/20 0.46
HTR2B P41595 1/20 0.44
DRD4 P21917 1/20 0.41
DRD5 P21918 1/20 0.41
DRD3 P35462 1/20 0.41
HTR2A P28223 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CES1 P23141 1/20 0.41

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
1,2,3,4-Tetrahydroisoquinoline SCHEMBL1788708 0.91 PNMT (0.66) HTR2CPNMTCD44MAOBKDM1A
1,2,3,4-Tetrahydroisoquinoline SCHEMBL29710285 0.91 PNMT (0.66) HTR2CPNMTCD44MAOBKDM1A
Trifluoroacetic Acid SCHEMBL4915477 0.81 DRD2 (0.59) HTR2CKDM1ADRD2DRD1HTR2B
Trifluoroacetic Acid SCHEMBL4782632 0.80 PNMT (0.43) PNMTCD44MAOBKDM1ACES1
Trifluoroacetic Acid SCHEMBL2310563 0.79 OPRD1 (0.57) HTR2BHTR2ACES1
Succinic Acid SCHEMBL16464058 0.78 HTR2C (0.64) HTR2CPNMTCD44MAOBDRD2
Fumaric Acid SCHEMBL12504903 0.78 HTR2C (0.64) HTR2CPNMTCD44MAOBDRD2
Maleic Acid SCHEMBL29496807 0.78 HTR2C (0.64) HTR2CPNMTCD44MAOBDRD2
Fumaric Acid SCHEMBL12504899 0.78 HTR2C (0.64) HTR2CPNMTCD44MAOBDRD2
Malonic Acid SCHEMBL12504943 0.78 HTR2C (0.64) HTR2CPNMTCD44MAOBDRD2

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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders CNR2, GRIN2C, GRIN2B HTR2C 12/4885PNMT 1171/4885CD44 4837/4885

“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.