SCHEMBL1287111

SCHEMBL1287111

CSC1=C(SC)C(=O)c2ccccc2C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 11/20 1.00
▸ CDC25A P30304 8/20 1.00
▸ MAP2K7 O14733 6/20 1.00
▸ S100A4 P26447 8/20 0.75
▸ MEN1 O00255 4/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ SOAT1 P35610 1/20 0.54
▸ APEX1 P27695 1/20 0.53
▸ MAPT P10636 4/20 0.52
▸ NPSR1 Q6W5P4 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ LMNA P02545 3/20 0.52
▸ RAB9A P51151 3/20 0.52
▸ BLM P54132 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ APAF1 O14727 3/20 0.52
▸ TDP2 O95551 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ PLA2G1B P04054 2/20 0.52
▸ THRB P10828 2/20 0.52

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
SCHEMBL2599369 0.86 S100A4 (1.00) CDC25BCDC25AMAP2K7S100A4MEN1
SCHEMBL30996023 0.84 CDC25B (0.72) CDC25BCDC25AMAP2K7S100A4MEN1
SCHEMBL11884727 0.84 CDC25B (0.72) CDC25BCDC25AMAP2K7S100A4MEN1
SCHEMBL11573754 0.84 CDC25B (0.72) CDC25BCDC25AMAP2K7S100A4MEN1
SCHEMBL14232080 0.81 CDC25A (0.67) CDC25BCDC25AMAP2K7S100A4MEN1
Anthraquinone SCHEMBL9329779 0.76 MEN1 (0.92) CDC25BCDC25AMAP2K7S100A4MEN1
Anthraquinone SCHEMBL5958714 0.74 CDC25B (0.86) CDC25BCDC25AMAP2K7S100A4MEN1
9,10-Phenanthrenequinone SCHEMBL28594289 0.74 S100A4 (0.93) CDC25BCDC25AMAP2K7S100A4MEN1
Bromide SCHEMBL28112335 0.74 MEN1 (0.86) CDC25BCDC25AMAP2K7S100A4MEN1
SCHEMBL10502004 0.73 NPC1 (0.59) CDC25BCDC25AMAP2K7S100A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040713-B2 Methods of managing blood sugar levels and compositions related thereto EMORY UNIVERSITY (US) 2015-05-26 — — US disclosed
US-20130158082-A1 METHODS OF MANAGING BLOOD SUGAR LEVELS AND COMPOSITIONS RELATED THERETO EMORY UNIVERSITY (US) 2013-06-20 — — US disclosed
WO-2012047628-A2 METHODS OF MANAGING BLOOD SUGAR LEVELS AND COMPOSITIONS RELATED THERETO EMORY UNIVERSITY (US) 2012-04-12 — — WO disclosed
WO-2005042442-A2 2-METHYLTHIO-1,4-NAPHTHOQUINONE DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND USE THEREOF Johannes Gutenberg-Universität Mainz (DE) 2005-05-12 — — WO disclosed
EP-0146145-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1989-08-30 — — EP disclosed
US-4593120-A Naphthalene-1,4-dicarboxylic acid group SYNTEX (U.S.A.) INC. (US) 1986-06-03 — — US disclosed
EP-0107512-B1 1,4-ACYLOXYNAPHTHALENE DERIVATIVES, TOPICAL COMPOSITIONS CONTAINING THEM, METHODS FOR THEIR PREPARATION, AND INTERMEDIATES THEREFOR SYNTEX (U.S.A.) INC. (US) 1986-02-26 — — EP disclosed
EP-0146145-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-06-26 — — EP disclosed
US-4466981-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1984-08-21 — — US disclosed
EP-0107512-A1 1,4-Acyloxynaphthalene derivatives, topical compositions containing them, methods for their preparation, and intermediates therefor SYNTEX (U.S.A.) INC. (US) 1984-05-02 — — EP 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-20130158082-A1 METHODS OF MANAGING BLOOD SUGAR LEVELS AND COMPOSITIONS RELATED THERETO SLC5A1, SLC2A1, SLC5A2 CDC25B 4287/4885CDC25A 3454/4885MAP2K7 3485/4885

“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.

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