SCHEMBL6661356

SCHEMBL6661356

COc1ccc([N+](=O)[O-])c(CCOC(=O)Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
PTPN1 P18031 1/20 0.45
ALDH1A1 P00352 4/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MAPT P10636 6/20 0.43
LMNA P02545 3/20 0.43
MAPK1 P28482 3/20 0.43
RAF1 P04049 1/20 0.43
HPGD P15428 1/20 0.43
GFER P55789 1/20 0.43
PAX8 Q06710 1/20 0.43
BACE1 P56817 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
AKR1B10 O60218 1/20 0.42
AKR1B1 P15121 1/20 0.42
AKR1C4 P17516 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42

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
SCHEMBL5051522 0.83 ALDH1A1 (0.50) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
SCHEMBL7647995 0.81 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL7649455 0.80 PTPN1 (0.47) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
SCHEMBL3601373 0.80 POLB (0.58) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
SCHEMBL5682398 0.79 ALDH1A1 (0.54) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
SCHEMBL22320958 0.78 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL16094929 0.77 ALDH1A1 (0.56) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
SCHEMBL2259328 0.77 TAAR1 (0.57) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
Acetic Acid SCHEMBL19873875 0.77 ADRA1A (0.50) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A
SCHEMBL28444987 0.77 POLB (0.52) SMN1; SMN2PTPN1ALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1299818-C Biopolymer synthesis substrate and method for producing biopolymers MICRONAS GMBH (DE) 2007-02-14 CN disclosed
CN-1599640-A Biopolymer synthesis substrate and method for producing biopolymers MICRONAS GMBH (DE) 2005-03-23 CN disclosed
EP-1441847-A1 BIOPOLYMER SYNTHESIS SUBSTRATE AND METHOD FOR PRODUCING BIOPOLYMERS Micronas GmbH (DE) 2004-08-04 EP disclosed
WO-2003041853-A1 BIOPOLYMER SYNTHESIS SUBSTRATE AND METHOD FOR PRODUCING BIOPOLYMERS MICRONAS GMBH (DE) 2003-05-22 WO disclosed
EP-0797580-B1 NUCLEOSIDE DERIVATIVES WITH PHOTOLABILE PROTECTIVE GROUPS PFLEIDERER WOLFGANG (DE) 2002-04-10 EP disclosed
US-5763599-A FOR LIGHT-CONTROLLED SYNTHESIS OF OLIGONUCLEOTIDES ON DNA CHIP Pfleiderer, Wolfgang (DE) 1998-06-09 US disclosed
EP-0797580-A2 NUCLEOSIDE DERIVATIVES WITH PHOTOLABILE PROTECTIVE GROUPS Pfleiderer, Wolfgang (DE) 1997-10-01 EP disclosed
WO-1996018634-A2 NUCLEOSIDE DERIVATIVES WITH PHOTOLABILE PROTECTIVE GROUPS PFLEIDERER WOLFGANG (DE) 1996-06-20 WO disclosed