SCHEMBL6206772

SCHEMBL6206772

OCCCCCc1nc2ccccc2o1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.68
MAPT P10636 2/20 0.68
RAB9A P51151 2/20 0.68
LOXL2 Q9Y4K0 1/20 0.60
TP53 P04637 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53
GFER P55789 1/20 0.53
DRD3 P35462 8/20 0.50
DRD2 P14416 6/20 0.50
DRD4 P21917 4/20 0.50
DRD1 P21728 2/20 0.50
HTR1A P08908 2/20 0.47
HTR2A P28223 1/20 0.47
FAAH O00519 1/20 0.46
CES1 P23141 1/20 0.46
DAGLA Q9Y4D2 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43

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
SCHEMBL5703655 0.98 MAPT (0.70) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL5693569 0.93 MAPT (0.72) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL11399187 0.89 MAPT (0.84) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL2123399 0.86 MAPT (0.78) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL31276791 0.86 MAPT (0.78) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL9642061 0.86 MAPT (0.84) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL7793708 0.83 MAPT (0.68) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL2567453 0.83 MAPT (0.68) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL11623669 0.83 MAPT (0.68) NPC1MAPTRAB9ALOXL2TP53
SCHEMBL3030438 0.83 NPC1 (0.68) NPC1MAPTRAB9ALOXL2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515726-A1 MORPHOLINE AND TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS CATHEPSIN INHIBITORS Aventis Pharmaceuticals, Inc. (US) 2005-03-23 EP disclosed
WO-2004002491-A1 MORPHOLINE AND TETRAHYDROPYRAN DRIVATIVES AND THEIR USE AS CATHEPSIN INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2004-01-08 WO disclosed
EP-0854388-B1 Negative-type image recording materials FUJI PHOTO FILM CO LTD (JP) 2003-08-13 EP disclosed
US-6068963-A CONTAINS (A) A POLYMER HAVING A HETEROCYCLIC GROUP CONTAINING AN UNSATURATED BOND THEREIN, (B) A CROSS-LINKING AGENT THAT CROSS-LINKS WITH THE AID OF AN ACID, AND (C) A COMPOUND THAT GENERATES AN ACID UPON EXPOSURE TO LIGHT OR HEAT. FUJI PHOTO FILM CO., LTD. (JP) 2000-05-30 US disclosed
EP-0949238-A1 SUBSTITUTED PROPIONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-10-13 EP disclosed
EP-0854388-A2 Negative-type image recording materials FUJI PHOTO FILM CO., LTD. (JP) 1998-07-22 EP disclosed