SCHEMBL13839756

SCHEMBL13839756

O=C(CNc1ccccc1SC/C=C/c1ccc(N2CCC(O)CC2)cc1)NCCSSCCNC(=O)C[n+]1c(/C=C/c2ccc(N3CCC(O)CC3)cc2)sc2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 1/20 0.34
▸ INSR P06213 2/20 0.31

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 0.88 SNCA (0.43) SNCAINSR
SCHEMBL13327498 0.71 HDAC3 (0.34) —
SCHEMBL13839766 0.69 SNCA (0.33) SNCAINSR
SCHEMBL13294091 0.69 INSR (0.42) INSR
SCHEMBL13294088 0.67 RORC (0.32) —
SCHEMBL18774306 0.66 HDAC3 (0.32) —
SCHEMBL3823383 0.66 WDR91 (0.35) —
SCHEMBL3823380 0.66 WDR91 (0.35) —
Hydrochloric Acid SCHEMBL3386424 0.65 WDR91 (0.34) —
SCHEMBL13327530 0.64 RORC (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2062945-A2 Hemicyanin styryl thiol/disulfide dye, dye composition comprising this dye, process for lightening keratin materials using this dye L'Oréal (FR) 2009-05-27 — — EP disclosed
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