Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL20189794

FC1(F)CNCC[C@@H]1CNc1ccncc1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 4/20 0.39
HRH3 Q9Y5N1 3/20 0.39
SSTR4 P31391 3/20 0.38
GRIN2B Q13224 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
FLT3 P36888 1/20 0.35
KDM1A O60341 1/20 0.35
GPR6 P46095 1/20 0.33
UBE2N P61088 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
PLOD2 O00469 1/20 0.32
PLOD3 O60568 1/20 0.32
PLOD1 Q02809 1/20 0.32

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 SCHEMBL20189426 1.00 HRH4 (0.39) HRH4HRH3SSTR4GRIN2BCYP2D6
SCHEMBL20202854 0.89 LRRK2 (0.34) SSTR4GRIN2BCYP2D6CYP2C9FLT3
SCHEMBL20202819 0.89 LRRK2 (0.34) SSTR4GRIN2BCYP2D6CYP2C9FLT3
SCHEMBL20202856 0.89 LRRK2 (0.34) SSTR4GRIN2BCYP2D6CYP2C9FLT3
Trifluoroacetic Acid SCHEMBL25432970 0.85 HRH4 (0.43) HRH4HRH3SSTR4GRIN2BCYP2D6
Trifluoroacetic Acid SCHEMBL20189703 0.85 HRH4 (0.43) HRH4HRH3SSTR4GRIN2BCYP2D6
Trifluoroacetic Acid SCHEMBL20189538 0.84 KDM4C (0.39) HRH4HRH3SSTR4GPR6
Trifluoroacetic Acid SCHEMBL20189608 0.83 HRH4 (0.44) HRH4HRH3SSTR4GRIN2B
Trifluoroacetic Acid SCHEMBL20189369 0.83 HRH4 (0.44) HRH4HRH3SSTR4GRIN2B
Trifluoroacetic Acid SCHEMBL18280984 0.82 GRIN2B (0.45) HRH4HRH3SSTR4GRIN2BCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12527799-B2 Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2026-01-20 US disclosed
US-20240207273-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2024-06-27 US disclosed
US-11752155-B2 Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2023-09-12 US disclosed
US-20210220365-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2021-07-22 US disclosed
US-11000526-B2 Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2021-05-11 US disclosed
US-20190298725-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2019-10-03 US disclosed
EP-3544610-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS Rugen Holdings (Cayman) Limited (KY) 2019-10-02 EP disclosed
WO-2018098128-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS RUGEN HOLDINGS (CAYMAN) LIMITED (KY) 2018-05-31 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 (6 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-11000526-B2 Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders GRIN2A, GRIN1, GRIN2B HRH4 433/4885HRH3 663/4885SSTR4 1317/4885
US-20190298725-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS GRIN2A, GRIN1, GRIN2B HRH4 433/4885HRH3 663/4885SSTR4 1317/4885
US-20210220365-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS GRIN2A, GRIN1, GRIN2B HRH4 433/4885HRH3 663/4885SSTR4 1317/4885
US-12527799-B2 Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders GRIN2C, GRIN3A, GRIN1 HRH4 135/4885HRH3 177/4885SSTR4 878/4885
US-11752155-B2 Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders GRIN2A, GRIN1, GRIN2B HRH4 433/4885HRH3 663/4885SSTR4 1317/4885
US-20240207273-A1 TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS GRIN2A, GRIN1, GRIN2B HRH4 433/4885HRH3 663/4885SSTR4 1317/4885

“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.