SCHEMBL13294114

SCHEMBL13294114

CN(CCSSCCN(C)c1ccc(/C=C/c2sc3cc(C(N)=O)ccc3[n+]2C)cc1)c1ccc(/C=C/c2sc3cc(C(N)=O)ccc3[n+]2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 18/20 0.50
▸ NSD2 O96028 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 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
SCHEMBL13294083 0.81 INSR (0.69) INSRNSD2POLBMAPTMAPK1
SCHEMBL13294104 0.75 INSR (0.60) INSRNSD2POLBMAPTMAPK1
SCHEMBL13294105 0.73 INSR (0.60) INSRNSD2POLBMAPTMAPK1
SCHEMBL13206620 0.71 INSR (0.70) INSRNSD2POLBMAPTMAPK1
SCHEMBL3941043 0.71 INSR (0.59) INSR
SCHEMBL14984268 0.70 INSR (0.82) INSRNSD2POLBMAPTMAPK1
SCHEMBL13294153 0.70 INSR (0.73) INSRNSD2MAPTMAPK1HTT
Iodide SCHEMBL3289688 0.69 INSR (0.71) INSRNSD2MAPTMAPK1HTT
SCHEMBL13005168 0.69 INSR (0.47) INSRPOLBMAPTMAPK1NPSR1
SCHEMBL10104040 0.69 MEN1 (0.58) MAPTHTTRAB9ANPSR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7727287-B2 Hemicyanin styryl thiol/disulfide dye, composition comprising hemicyanin styryl thoil/disulfide dye, and method for lightening keratin materials using hemicyanin styryl thiol/disulfide dye L'OREAL S.A. (FR) 2010-06-01 — — US disclosed
US-20090211038-A1 HEMICYANIN STYRYL THIOL/DISULFIDE DYE, COMPOSITION COMPRISING HEMICYANIN STYRYL THIOL/DISULFIDE DYE, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING HEMICYANIN STYRYL THIOL/DISULFIDE DYE L'OREAL S.A. (FR) 2009-08-27 — — 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-20090211038-A1 HEMICYANIN STYRYL THIOL/DISULFIDE DYE, COMPOSITION COMPRISING HEMICYANIN STYRYL THIOL/DISULFIDE DYE, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING HEMICYANIN STYRYL THIOL/DISULFIDE DYE KRT18, SCNN1B, TST INSR 4743/4885NSD2 2056/4885POLB 2263/4885

“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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