SCHEMBL4076689

SCHEMBL4076689

O=C1OC=NC1(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.40
BACE2 Q9Y5Z0 4/20 0.40
CYP2C9 P11712 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
THRB P10828 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
REN P00797 1/20 0.37
APP P05067 1/20 0.37
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CNR1 P21554 1/20 0.34
MAOB P27338 5/20 0.33
MAOA P21397 3/20 0.33
CFTR P13569 1/20 0.33
GOPC Q9HD26 1/20 0.33
MEN1 O00255 1/20 0.32

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
SCHEMBL6827479 0.65 BACE1 (0.43) BACE1BACE2CYP2C9KMT2ALMNA
SCHEMBL7635908 0.62 CFTR (0.56) CYP2C9KMT2ALMNABLMPMP22
SCHEMBL11469864 0.61 CFTR (0.39) BACE1BACE2CYP2C9KMT2ALMNA
SCHEMBL9304904 0.61 CFTR (0.54) CYP2C9KMT2ALMNABLMPMP22
SCHEMBL9823653 0.61 BACE1 (0.39) BACE1BACE2CYP2C9KMT2ALMNA
SCHEMBL9482559 0.61 BACE1 (0.39) BACE1BACE2CYP2C9KMT2ALMNA
SCHEMBL4397735 0.60 CFTR (0.34) BACE1BACE2CYP2C9KMT2ALMNA
SCHEMBL11881667 0.60 MMP2 (0.41) CYP2C9SMN1; SMN2CFTRGOPC
SCHEMBL28548234 0.59 HCAR2 (0.53) SMN1; SMN2CFTRGOPC
SCHEMBL3641710 0.58 BACE1 (0.33) BACE1BACE2CYP2C9KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2931790-A1 ACTINICALLY-CROSSLINKABLE AMPHIPHILIC PREPOLYMERS Novartis AG (CH) 2015-10-21 EP disclosed
WO-2014093756-A1 ACTINICALLY-CROSSLINKABLE AMPHIPHILIC PREPOLYMERS NOVARTIS AG (CH) 2014-06-19 WO disclosed
EP-2034994-A2 NF-KAPPA B INHIBITORS AND USES THEREOF The Board Of Trustees Operating Michigan State University (US) 2009-03-18 EP disclosed
WO-2007133790-A2 NF-ϰB INHIBITORS AND USES THEREOF THE BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY (US) 2007-11-22 WO disclosed
US-4009039-A Heat developable light-sensitive oxazoline containing element FUJI PHOTO FILM CO., LTD. (JA) 1977-02-22 US disclosed