SCHEMBL29403453

SCHEMBL29403453

CCn1c2ccccc2c2cc([S+](c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.58
▸ KDM4E B2RXH2 7/20 0.58
▸ KMT2A Q03164 4/20 0.58
▸ ALDH1A1 P00352 4/20 0.58
▸ MEN1 O00255 3/20 0.58
▸ HTT P42858 2/20 0.58
▸ MAPK1 P28482 2/20 0.58
▸ HPGD P15428 1/20 0.58
▸ HBB P68871 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ LMNA P02545 5/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.52
▸ POLB P06746 2/20 0.50
▸ PKM P14618 1/20 0.50
▸ SRC P12931 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ RAC2 P15153 1/20 0.46
▸ RAC3 P60763 1/20 0.46
▸ CDC42 P60953 1/20 0.46

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
SCHEMBL11921074 1.00 MAPT (0.58) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL9609400 0.79 ALDH1A1 (0.59) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL11921071 0.78 MAPT (0.54) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL13979310 0.77 KDM4E (0.70) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL29963695 0.77 ALDH1A1 (0.75) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL29360167 0.77 ALDH1A1 (0.75) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL151563 0.77 ALDH1A1 (0.75) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL31027168 0.76 MAPT (0.69) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL14805532 0.76 MAPT (0.69) MAPTKDM4EKMT2AALDH1A1MEN1
SCHEMBL14805531 0.76 MAPT (0.69) MAPTKDM4EKMT2AALDH1A1MEN1

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
CN-109554122-B Curing adhesive for polarizing film, optical film, and image display device 日东电工株式会社 2022-03-01 — — CN disclosed
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