SCHEMBL20189738

SCHEMBL20189738

Cc1cc(OC(F)(F)F)ccc1-c1ccn2nccc2n1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 5/20 0.65
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
CYP1A2 P05177 3/20 0.47
TGFBR1 P36897 3/20 0.43
DYRK1A Q13627 2/20 0.42
PDE10A Q9Y233 2/20 0.36
GPR3 P46089 1/20 0.36
PDE2A O00408 1/20 0.36
PDE7A Q13946 1/20 0.36
PDE11A Q9HCR9 1/20 0.36
KCNN3 Q9UGI6 2/20 0.36
MCHR1 Q99705 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
SCHEMBL20190634 0.86 SCN5A (0.62) SCN5AMAOAMAOBTGFBR1DYRK1A
SCHEMBL20190267 0.83 SCN5A (0.59) SCN5AMAOAMAOBCYP1A2TGFBR1
SCHEMBL20190623 0.79 SCN5A (1.00) SCN5AMAOAMAOBCYP1A2TGFBR1
SCHEMBL20189286 0.78 SCN5A (0.67) SCN5AMAOAMAOBCYP1A2TGFBR1
SCHEMBL20190776 0.78 SCN5A (0.58) SCN5AMAOAMAOBCYP1A2PDE10A
SCHEMBL20190446 0.77 SCN5A (0.51) SCN5AMAOAMAOBCYP1A2DYRK1A
SCHEMBL20190420 0.76 SCN5A (0.65) SCN5ATGFBR1DYRK1A
SCHEMBL20190530 0.71 CYP1A2 (0.45) SCN5AMAOAMAOBCYP1A2DYRK1A
SCHEMBL26361527 0.71 SCN5A (0.50) SCN5AMAOAMAOBCYP1A2GPR3
SCHEMBL26361552 0.70 CYP1A2 (0.48) SCN5AMAOAMAOBCYP1A2DYRK1A

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 8/4885MAOA 1799/4885MAOB 1870/4885

“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.