SCHEMBL22314922

SCHEMBL22314922

Cc1nc(Cn2c(=O)oc3ccc(-c4ccc(OC(F)(F)F)cc4)nc32)co1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
SCN5A Q14524 8/20 0.41
GRIN2B Q13224 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
PSD A5PKW4 1/20 0.35
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
TNIK Q9UKE5 1/20 0.33
ENPP3 O14638 1/20 0.33
MYC P01106 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL22314914 0.84 SCN5A (0.40) SCN5AGRIN2BTLR7PSDSCN1A
SCHEMBL22314208 0.83 SCN5A (0.41) TP53SCN5AGRIN2BPSDSCN1A
SCHEMBL22314912 0.83 SCN5A (0.52) TP53SCN5AGRIN2BPSDSCN1A
SCHEMBL25865160 0.83 SCN5A (0.41) TP53SCN5AGRIN2BPSDSCN1A
SCHEMBL22314514 0.82 SCN5A (0.45) SCN5AGRIN2BPSDNOTUM
SCHEMBL25865147 0.82 PDE5A (0.42) SCN5AGRIN2BSCN1ASCN2ATNIK
SCHEMBL25865032 0.81 SCN5A (0.44) SCN5AGRIN2BPSDTNIKNOTUM
SCHEMBL22314548 0.81 SCN5A (0.43) SCN5AGRIN2BPSDTNIKNOTUM
SCHEMBL22314994 0.81 SCN5A (0.38) SCN5AGRIN2BTNIK
SCHEMBL22314918 0.81 SCN5A (0.52) SCN5AGRIN2BPSDSCN1ASCN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PREC MEDICINES INC (US) 2023-07-13 US disclosed
US-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PREC MEDICINES INC (US) 2023-07-13 US disclosed
US-20200247793-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2020-08-06 US 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 (2 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-20200247793-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B TP53 4487/4885SCN5A 8/4885GRIN2B 120/4885
US-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B TP53 4487/4885SCN5A 8/4885GRIN2B 120/4885

“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.