SCHEMBL14393718

SCHEMBL14393718

CN(CCSc1sc2ccccc2[n+]1C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 14/20 0.48
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ HTT P42858 3/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ THRB P10828 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ ALPG P10696 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ NSD2 O96028 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ APP P05067 1/20 0.39
▸ CHAT P28329 1/20 0.38
▸ NPC1 O15118 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
SCHEMBL14393735 0.91 INSR (0.48) INSRMEN1KMT2AMAPTHTT
SCHEMBL14393541 0.90 INSR (0.45) INSRMEN1KMT2AMAPTHTT
SCHEMBL14393886 0.83 INSR (0.42) INSRMEN1KMT2AMAPTHTT
SCHEMBL14393717 0.77 MEN1 (0.42) INSRMEN1KMT2AMAPTHTT
SCHEMBL13294083 0.77 INSR (0.69) INSRMAPTHTTNPSR1POLB
SCHEMBL14393542 0.77 MEN1 (0.46) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL14393537 0.76 MEN1 (0.47) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL10104040 0.76 MEN1 (0.58) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL14146585 0.74 MEN1 (0.57) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL13645967 0.74 MEN1 (0.68) MEN1KMT2AMAPTHTTNPSR1

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
WO-2007110534-A2 DYEING COMPOSITION COMPRISING A THIOL/DISULPHIDE FLUORESCENT COLORANT HAVING AN EXTERNAL CATIONIC CHARGE, AND METHOD FOR LIGHTENING KERATIN MATERIALS USING SAID COLORANT L'ORÉAL (FR) 2007-10-04 — — WO disclosed
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