SCHEMBL13294091

SCHEMBL13294091

CC(=O)Nc1ccc(/C=C/c2sc3ccccc3[n+]2CC(=O)NCCSSCCNC(=O)C[n+]2c(/C=C/c3ccc(NC(C)=O)cc3)sc3ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 13/20 0.42
▸ MAPT P10636 4/20 0.41
▸ RAB9A P51151 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPK1 P28482 1/20 0.37

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
SCHEMBL13294099 0.79 SNCA (0.43) INSR
SCHEMBL13294128 0.79 INSR (0.50) INSRMAPTRAB9ANPC1KMT2A
SCHEMBL13294121 0.73 INSR (0.52) INSRMAPTRAB9ANPC1KMT2A
SCHEMBL16549701 0.72 GAA (0.44) MAPTRAB9AALDH1A1MEN1NPC1
Hydrochloric Acid SCHEMBL16538956 0.71 GAA (0.43) MAPTRAB9AALDH1A1MEN1NPC1
Hydrochloric Acid SCHEMBL16538959 0.71 GAA (0.43) MAPTRAB9AALDH1A1MEN1NPC1
SCHEMBL16549751 0.69 KMT2A (0.39) MAPTRAB9AALDH1A1POLBMEN1
SCHEMBL16676666 0.69 KMT2A (0.40) MAPTRAB9AALDH1A1POLBMEN1
Iodide SCHEMBL1243530 0.68 INSR (0.53) INSRMAPTRAB9APOLBMAPK1
SCHEMBL16144029 0.68 INSR (0.51) INSRMAPTALDH1A1LMNAPOLB

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 4743/4885MAPT 764/4885RAB9A 4381/4885

“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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