SCHEMBL11889773

SCHEMBL11889773

COc1ccccc1COC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(O)cc3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.54
▸ LMNA P02545 3/20 0.54
▸ NPC1 O15118 6/20 0.52
▸ RAB9A P51151 6/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ GAA P10253 1/20 0.51
▸ TYR P14679 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ USP2 O75604 3/20 0.50
▸ POLB P06746 1/20 0.50
▸ KMT2A Q03164 4/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ AHR P35869 1/20 0.49
▸ GFER P55789 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ NR4A1 P22736 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ HSD17B10 Q99714 2/20 0.48
▸ HPGD P15428 1/20 0.48

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
SCHEMBL11889747 0.93 NPC1 (0.52) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL11889725 0.88 MAPT (0.56) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL11889855 0.87 KMT2A (0.53) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL11889599 0.85 F13A1 (0.53) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL11889651 0.84 MAPT (0.65) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL11889801 0.83 MAPT (0.74) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL12306055 0.82 RAB9A (0.63) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL11889586 0.81 MAPT (0.58) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL22495372 0.80 MAPT (0.71) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL2459317 0.80 MAPT (0.57) MAPTLMNANPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101035777-B HCV replication modulators ANGELETTI P IST RICHERCHE BIO 2013-01-02 — — CN disclosed
EP-1799663-B1 Modulators of HCV replication ANGELETTI P IST RICHERCHE BIO (IT) 2012-08-01 — — EP disclosed
CN-101035777-A HCV replication modulators ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 — — CN disclosed
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