SCHEMBL9249462

SCHEMBL9249462

Cc1ccc2c(ccc(=O)n2COC(=O)C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.39
▸ GAA P10253 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ CCR9 P51686 1/20 0.37
▸ MAPT P10636 3/20 0.36
▸ LMNA P02545 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.35
▸ TP53 P04637 3/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ NOD2 Q9HC29 1/20 0.35
▸ NOD1 Q9Y239 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ THRB P10828 2/20 0.34
▸ KMO O15229 1/20 0.33
▸ FABP4 P15090 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
SCHEMBL9252947 0.84 POLB (0.36) POLBGAANPSR1CCR9MAPT
SCHEMBL14564431 0.75 KDM4E (0.49) POLBMAPTLMNAKDM4ETP53
SCHEMBL14564395 0.74 MAPT (0.51) POLBNPSR1MAPTLMNAMEN1
SCHEMBL9310207 0.74 BTK (0.52) POLBGAAMAPTLMNAKMT2A
SCHEMBL28104161 0.72 GAA (0.41) POLBGAANPSR1MAPTKMT2A
SCHEMBL17979387 0.71 MAPT (0.45) POLBMAPTKDM4EHSD17B10L3MBTL1
SCHEMBL637196 0.71 NPC1 (0.42) POLBMAPTLMNAKMT2AKDM4E
SCHEMBL9245910 0.71 POLB (0.45) POLBGAANPSR1MAPTLMNA
SCHEMBL2796642 0.70 MAPT (0.40) POLBMAPTLMNAKDM4ETP53
SCHEMBL2795454 0.69 TP53 (0.39) POLBMAPTLMNAKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5401751-A Enzyme inhibitors for 5-lipoxygenase ZENECA LIMITED (GB) 1995-03-28 — — US disclosed
US-5236919-A Inhibitorsof enzyme 5-lipoxygenase IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-08-17 — — US disclosed
US-5134148-A Heterocycles for use as inhibitors of leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-28 — — US disclosed
EP-0385662-A2 Heterocycles with inhibitory activity of 5-lipoxygenase ZENECA LIMITED (GB) 1990-09-05 — — EP disclosed
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