SCHEMBL25865235

SCHEMBL25865235

CCCCn1c(=O)oc2ccc(-c3ccc(OC(F)(F)F)cc3)nc21

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 3/20 0.42
SCN9A Q15858 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.38
GRIN2B Q13224 1/20 0.37
DYRK1A Q13627 3/20 0.36
CDK9 P50750 1/20 0.36
NOTUM Q6P988 1/20 0.36
BRD4 O60885 1/20 0.36
PSD A5PKW4 1/20 0.36
TDP2 O95551 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
SCHEMBL25865091 0.94 SCN5A (0.43) SCN5ASCN9AALDH1A1KDM4EHPGD
SCHEMBL22314953 0.89 SCN5A (0.39) SCN5AGRIN2BNOTUM
SCHEMBL22314514 0.89 SCN5A (0.45) SCN5AGRIN2BNOTUMPSD
SCHEMBL25865032 0.88 SCN5A (0.44) SCN5AGRIN2BNOTUMPSD
SCHEMBL22314952 0.86 SCN5A (0.38) SCN5AALDH1A1HPGDTSHRNPSR1
SCHEMBL22314548 0.85 SCN5A (0.43) SCN5AALDH1A1KDM4EGRIN2BDYRK1A
SCHEMBL22314910 0.85 SCN5A (0.40) SCN5ASCN9AGRIN2BNOTUMBRD4
SCHEMBL22314905 0.85 SCN5A (0.40) SCN5ASCN9AGRIN2BNOTUMBRD4
SCHEMBL22315052 0.85 SCN5A (0.40) SCN5ASCN9AGRIN2BNOTUMBRD4
SCHEMBL20472119 0.85 SCN5A (0.40) SCN5AGRIN2BPSD

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 1 patent. 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

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-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B SCN5A 8/4885SCN9A 42/4885ALDH1A1 916/4885

“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.