SCHEMBL3310991

SCHEMBL3310991

Cc1cc2c([nH]c3ccccc32)c2c1OC(C)(C)CC2c1cccc2c1[nH]c1c3c(c(C)cc12)OC(C)(C)C=C3

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.66
▸ POLB P06746 2/20 0.66
▸ XBP1 P17861 2/20 0.66
▸ NPC1 O15118 1/20 0.66
▸ RAB9A P51151 1/20 0.66
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ PNLIP P16233 1/20 0.46
▸ HSD17B10 Q99714 2/20 0.39
▸ GAA P10253 1/20 0.36
▸ IDE P14735 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KIF11 P52732 1/20 0.33
▸ DYRK1A Q13627 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 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
Grinimibine SCHEMBL4132680 0.81 MAPT (1.00) MAPTPOLBXBP1NPC1RAB9A
SCHEMBL29502491 0.68 MAPT (0.72) MAPTPOLBXBP1NPC1RAB9A
SCHEMBL30929792 0.66 MAPT (0.69) MAPTPOLBXBP1NPC1RAB9A
Koenimbine SCHEMBL29581663 0.66 MAPT (0.69) MAPTPOLBXBP1NPC1RAB9A
SCHEMBL30929796 0.66 MAPT (0.65) MAPTPOLBXBP1NPC1RAB9A
Mahanimbine SCHEMBL18488200 0.63 MAPT (1.00) MAPTPOLBXBP1NPC1RAB9A
Mahanimbine SCHEMBL2991765 0.63 MAPT (1.00) MAPTPOLBXBP1NPC1RAB9A
Mahanimbine SCHEMBL18488203 0.63 MAPT (1.00) MAPTPOLBXBP1NPC1RAB9A
SCHEMBL31324179 0.63 MAPT (0.60) MAPTPOLBXBP1NPC1RAB9A
SCHEMBL6052168 0.62 MAPT (0.43) MAPTPOLBXBP1NPC1RAB9A

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-20100098788-A1 Extracts of Curcuma and Methods of Use Thereof HERBALSCIENCE GROUP, LLC 2010-04-22 — — US disclosed
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