SCHEMBL23845935

SCHEMBL23845935

O=c1c2cc(F)ccc2sn1-c1nc2ccc(OC(F)(F)F)cc2s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 2/20 0.50
SCN9A Q15858 2/20 0.50
MPI P34949 8/20 0.49
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
PMM2 O15305 5/20 0.49
APOBEC3G Q9HC16 4/20 0.49
MIF P14174 4/20 0.49
PHOSPHO1 Q8TCT1 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
GMNN O75496 1/20 0.47
USP2 O75604 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL21687129 0.87 MPI (0.63) MPINPC1RAB9APMM2APOBEC3G
SCHEMBL21687126 0.87 KAT2A (0.64) SCN4ASCN9AMPINPC1RAB9A
SCHEMBL21687128 0.80 CSNK1D (0.47) SCN4ASCN9ANPC1RAB9AMIF
SCHEMBL23845934 0.78 SCN4A (0.47) SCN4ASCN9ANPC1RAB9AMIF
SCHEMBL21687124 0.72 KAT2A (0.68) MPINPC1RAB9APMM2APOBEC3G
SCHEMBL10489874 0.71 SCN4A (0.57) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
Phathalimide SCHEMBL30007061 0.71 SCN4A (0.56) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL16445277 0.69 SCN4A (0.79) SCN4ASCN9ANPC1RAB9AAPOBEC3G
SCHEMBL8516006 0.67 SCN4A (1.00) SCN4ASCN9ANPC1RAB9ASMN1; SMN2
SCHEMBL30450972 0.67 ALDH1A1 (0.61) SCN4ASCN9ANPC1RAB9ASMN1; SMN2

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-20210292315-A1 SELENIUM-CONTAINING ISOXAZOLAMINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF SHANGHAI XINGYE PHARMACEUTICAL TECHNOLOGY CO., LTD (CN) 2021-09-23 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-20210292315-A1 SELENIUM-CONTAINING ISOXAZOLAMINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF AIFM2, GPX1, AIFM1 SCN4A 1148/4885SCN9A 1731/4885MPI 3496/4885

“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.