SCHEMBL20190446

SCHEMBL20190446

Cc1cc(OC(F)(F)F)ccc1-c1cc2ccnn2cn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 4/20 0.51
CYP1A2 P05177 3/20 0.47
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
DYRK1A Q13627 1/20 0.38
GPR3 P46089 3/20 0.37
FFAR4 Q5NUL3 1/20 0.37
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
DRD1 P21728 2/20 0.36
CHRM5 P08912 1/20 0.36
ABL1 P00519 1/20 0.36
BCR P11274 1/20 0.36
HRH4 Q9H3N8 1/20 0.35

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
SCHEMBL26361552 0.81 CYP1A2 (0.48) SCN5ACYP1A2MAOAMAOBDYRK1A
SCHEMBL20190305 0.80 SCN5A (0.68) SCN5ACYP1A2MAOAMAOBABL1
SCHEMBL20190452 0.78 SCN5A (0.55) SCN5ACYP1A2MAOAMAOBGPR3
SCHEMBL22712306 0.78 CYP1A2 (0.50) SCN5ACYP1A2MAOAMAOBDYRK1A
SCHEMBL20190530 0.77 CYP1A2 (0.45) SCN5ACYP1A2MAOAMAOBDYRK1A
SCHEMBL20190211 0.77 CYP1A2 (0.47) SCN5ACYP1A2MAOAMAOBDYRK1A
SCHEMBL20189738 0.77 SCN5A (0.65) SCN5ACYP1A2MAOAMAOBDYRK1A
SCHEMBL20190430 0.75 CYP1A2 (0.43) SCN5ACYP1A2MAOAMAOBDYRK1A
SCHEMBL26361527 0.74 SCN5A (0.50) SCN5ACYP1A2MAOAMAOBGPR3
SCHEMBL20191130 0.73 SCN5A (0.47) SCN5ACYP1A2MAOAMAOBGPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
US-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
WO-2018098500-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2018-05-31 WO disclosed
WO-2018098500-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 (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-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B SCN5A 8/4885CYP1A2 1988/4885MAOA 1799/4885

“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.