SCHEMBL20190388

SCHEMBL20190388

Cc1nc(NN=C(Br)C(F)(F)F)cnc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
GABBR2 O75899 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35
CYP1A2 P05177 1/20 0.35
SCN10A Q9Y5Y9 3/20 0.34
SCN5A Q14524 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL20190386 1.00 CACNA2D1 (0.37) CACNA2D1TRPV1ADORA3GABBR2GABBR1
SCHEMBL20189716 0.85 MALT1 (0.34) CACNA2D1TRPV1ADORA3GABBR2GABBR1
SCHEMBL20189715 0.85 MALT1 (0.34) CACNA2D1TRPV1ADORA3GABBR2GABBR1
SCHEMBL20189464 0.84 CYP1A2 (0.34) CACNA2D1TRPV1ADORA3CYP1A2SCN10A
SCHEMBL20189463 0.84 CYP1A2 (0.34) CACNA2D1TRPV1ADORA3CYP1A2SCN10A
SCHEMBL20189969 0.81 GABBR2 (0.37) CACNA2D1TRPV1ADORA3GABBR2GABBR1
SCHEMBL20189968 0.81 GABBR2 (0.37) CACNA2D1TRPV1ADORA3GABBR2GABBR1
SCHEMBL20189809 0.78 SCN10A (0.41) CACNA2D1TRPV1ADORA3GABBR2GABBR1
SCHEMBL20190247 0.72 CACNA2D1 (0.42) CACNA2D1TRPV1GABBR2GABBR1SCN10A
SCHEMBL30448770 0.72 CACNA2D1 (0.42) CACNA2D1TRPV1GABBR2GABBR1SCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250163068-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2025-05-22 US disclosed
EP-4397308-A2 COMPOUNDS AND THEIR METHODS OFUSE Praxis Precision Medicines, Inc. (US) 2024-07-10 EP disclosed
EP-3548033-B1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PREC MEDICINES INC (US) 2024-04-10 EP disclosed
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-10-12 US disclosed
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-10-12 US disclosed
US-11629146-B2 Substituted [1,2,4]triazolo[4,3-a]pyrazines as modulators of sodium channel activity PRAXIS PRECISION MEDICINES, INC. (US) 2023-04-18 US disclosed
US-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
EP-3548033-A1 COMPOUNDS AND THEIR METHODS OF USE Praxis Precision Medicines, Inc. (US) 2019-10-09 EP disclosed
WO-2018098499-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 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 (4 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-11629146-B2 Substituted [1,2,4]triazolo[4,3-a]pyrazines as modulators of sodium channel activity SCN1A, SCN5A, SCN3A CACNA2D1 103/4885TRPV1 95/4885ADORA3 2127/4885
US-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CACNA2D1 78/4885TRPV1 123/4885ADORA3 2285/4885
US-20250163068-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CACNA2D1 78/4885TRPV1 123/4885ADORA3 2285/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CACNA2D1 78/4885TRPV1 123/4885ADORA3 2285/4885

“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.