SCHEMBL17798993

SCHEMBL17798993

CCCNS(=O)(=O)c1ccc(C)cc1.[NaH]

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.69
CA12 O43570 3/20 0.68
CA9 Q16790 3/20 0.68
CA2 P00918 2/20 0.68
CA1 P00915 1/20 0.68
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
LMNA P02545 1/20 0.58
HPGD P15428 1/20 0.58
HTT P42858 1/20 0.58
ALOX15 P16050 1/20 0.58
GAA P10253 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.54
GBA1 P04062 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
ATM Q13315 1/20 0.54
MBTD1 Q05BQ5 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL634316 0.98 ALDH1A1 (0.71) ALDH1A1CA12CA9CA2CA1
Propylamine SCHEMBL11775095 0.91 CA12 (0.67) ALDH1A1CA12CA9CA2CA1
SCHEMBL8213969 0.90 ALDH1A1 (0.72) ALDH1A1CA12CA9CA2MEN1
SCHEMBL5567042 0.88 ALDH1A1 (0.75) ALDH1A1CA12CA9CA2MEN1
SCHEMBL187922 0.87 ALDH1A1 (0.72) ALDH1A1CA12CA9CA2MEN1
SCHEMBL635208 0.85 ALDH1A1 (0.70) ALDH1A1CA12CA9CA2MEN1
SCHEMBL7201051 0.84 ALDH1A1 (0.86) ALDH1A1CA12CA9CA2MEN1
SCHEMBL7094852 0.84 ALDH1A1 (0.79) ALDH1A1CA12CA9CA2MEN1
SCHEMBL8355315 0.84 ALDH1A1 (0.72) ALDH1A1CA12CA9CA2MEN1
SCHEMBL223156 0.84 ALDH1A1 (0.72) ALDH1A1CA12CA9CA2MEN1

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
CN-105636969-B Compound, curing catalysts, epoxy resin component and the device using its manufacture of Han You Phosphonium ions 三星SDI株式会社 2018-02-13 CN disclosed
US-20160159971-A1 COMPOUND CONTAINING PHOSPHONIUM ION, EPOXY RESIN COMPOSITION CONTAINING SAME, AND DEVICE MANUFACTURED BY USING SAME SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
CN-105636969-A Compound containing phosphonium ion, epoxy resin composition containing same, and device manufactured by using same SAMSUNG SDI CO LTD 2016-06-01 CN 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-20160159971-A1 COMPOUND CONTAINING PHOSPHONIUM ION, EPOXY RESIN COMPOSITION CONTAINING SAME, AND DEVICE MANUFACTURED BY USING SAME PHOSPHO1, PSMA1, PPA1 ALDH1A1 1830/4885CA12 3364/4885CA9 1447/4885

“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.