SCHEMBL20189464

SCHEMBL20189464

COCc1nc(NN=C(Br)C(F)(F)F)cnc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CACNA2D1 P54289 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
KCNH2 Q12809 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
CHRNA7 P36544 3/20 0.33
MERTK Q12866 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
MALT1 Q9UDY8 2/20 0.33
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
PPARD Q03181 1/20 0.32
PDE2A O00408 1/20 0.32
PIK3CD O00329 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
SCHEMBL20189463 1.00 CYP1A2 (0.34) CYP1A2CACNA2D1TRPV1KCNH2SCN10A
SCHEMBL20189715 0.91 MALT1 (0.34) CYP1A2CACNA2D1TRPV1CHRNA7MERTK
SCHEMBL20189716 0.91 MALT1 (0.34) CYP1A2CACNA2D1TRPV1CHRNA7MERTK
SCHEMBL20190388 0.84 CACNA2D1 (0.37) CYP1A2CACNA2D1TRPV1SCN10AADORA3
SCHEMBL20190386 0.84 CACNA2D1 (0.37) CYP1A2CACNA2D1TRPV1SCN10AADORA3
SCHEMBL20190208 0.82 SCN10A (0.35) CYP1A2CACNA2D1KCNH2SCN10ACHRNA7
SCHEMBL20190206 0.82 SCN10A (0.35) CYP1A2CACNA2D1KCNH2SCN10ACHRNA7
SCHEMBL20190189 0.81 SCN10A (0.41) CYP1A2CACNA2D1KCNH2SCN10ACHRNA7
SCHEMBL29259684 0.78 CYP1A2 (0.42) CYP1A2CACNA2D1TRPV1KCNH2SCN10A
SCHEMBL23571917 0.77 CYP1A2 (0.39) CYP1A2CACNA2D1KCNH2SCN10ACHRNA7

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 CYP1A2 2190/4885CACNA2D1 103/4885TRPV1 95/4885
US-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885CACNA2D1 78/4885TRPV1 123/4885
US-20250163068-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885CACNA2D1 78/4885TRPV1 123/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885CACNA2D1 78/4885TRPV1 123/4885

“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.