SCHEMBL11137447

SCHEMBL11137447

CCC(C)Cc1ccc(Sc2cccc3c2C(=O)c2cccc(Sc4ccc(CC(C)CC)cc4)c2C3=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ NSD2 O96028 1/20 0.50
▸ SLC6A4 P31645 4/20 0.40
▸ ADORA2A P29274 2/20 0.36
▸ MAOA P21397 4/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAOB P27338 2/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ BCL2 P10415 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL28746677 0.77 MAPT (0.64) MAPTMAPK1KDM4ENSD2SLC6A4
SCHEMBL22827088 0.75 MAPT (0.60) MAPTMAPK1KDM4ENSD2SLC6A4
SCHEMBL4485448 0.75 MAPT (0.64) MAPTMAPK1KDM4ENSD2ADORA2A
SCHEMBL10444705 0.74 KDM4E (0.49) MAPTMAPK1KDM4ENSD2SLC6A4
SCHEMBL5187613 0.74 MAPT (0.68) MAPTMAPK1KDM4ENSD2ADORA2A
SCHEMBL26714273 0.74 MAPT (0.45) MAPTMAPK1KDM4ENSD2ADORA2A
SCHEMBL10938974 0.73 MAPT (0.44) MAPTMAPK1MAOAL3MBTL1MEN1
SCHEMBL10873188 0.73 MAPT (0.57) MAPTMAPK1KDM4ENSD2ADORA2A
SCHEMBL11489084 0.73 MAPT (0.50) MAPTMAPK1KDM4ENSD2MAOA
SCHEMBL10729138 0.73 MAPT (0.57) MAPTMAPK1KDM4ENSD2ADORA2A

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
US-4394070-A Helichromic compounds and displays MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-07-19 — — US disclosed
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