SCHEMBL13294092

SCHEMBL13294092

Cn1c(/C=C/c2cc3c4c(c2)CCCN4CCC3)[n+](CC(=O)NCCSSCCNC(=O)C[n+]2c(/C=C/c3cc4c5c(c3)CCCN5CCC4)n(C)c3ccccc32)c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 5/20 0.32
▸ CHRM2 P08172 2/20 0.31
▸ CHRM4 P08173 2/20 0.31
▸ CHRM5 P08912 2/20 0.31
▸ CHRM1 P11229 2/20 0.31
▸ CHRM3 P20309 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CREBBP Q92793 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ MTNR1A P48039 1/20 0.30
▸ MTNR1B P49286 1/20 0.30

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
SCHEMBL13839747 0.87 — —
SCHEMBL13294103 0.84 RAD52 (0.31) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL3818024 0.82 ALDH1A1 (0.33) NPY1RCHRM2CHRM4CHRM5CHRM1
SCHEMBL3818026 0.82 ALDH1A1 (0.33) NPY1RCHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL3294880 0.81 ALDH1A1 (0.32) NPY1RKDM4EALDH1A1
SCHEMBL10104223 0.78 LMNA (0.33) NPY1RKDM4EALDH1A1HPGDMAPK1
SCHEMBL13294218 0.77 ALDH1A1 (0.32) NPY1RKDM4EALDH1A1
SCHEMBL13294088 0.77 RORC (0.32) —
SCHEMBL13926102 0.76 KMT2A (0.40) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL13839753 0.75 — —

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 NPY1R 4384/4885CHRM2 2026/4885CHRM4 2075/4885

“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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