SCHEMBL6360563

SCHEMBL6360563

COc1ccccc1-c1nc(-c2ccccc2)c(-c2ccccc2)n1-n1c(-c2ccccc2OC)nc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
KDM4E B2RXH2 3/20 0.59
LMNA P02545 2/20 0.59
GAA P10253 2/20 0.59
SMN1; SMN2 Q16637 3/20 0.51
ADORA2A P29274 2/20 0.46
ADORA1 P30542 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
DPP4 P27487 1/20 0.44
DCUN1D1 Q96GG9 1/20 0.44
MGAM O43451 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
PDE2A O00408 1/20 0.43
PDE10A Q9Y233 1/20 0.43
HPGD P15428 1/20 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
SCHEMBL31467270 1.00 ALDH1A1 (0.59) ALDH1A1KDM4ELMNAGAASMN1; SMN2
SCHEMBL28919628 0.87 KDM4E (0.49) ALDH1A1KDM4ELMNAGAASMN1; SMN2
SCHEMBL14670716 0.85 KDM4E (0.56) ALDH1A1KDM4ELMNAGAASMN1; SMN2
SCHEMBL29842269 0.84 AKT1 (0.43) ALDH1A1KDM4ELMNAGAAL3MBTL1
SCHEMBL62462 0.84 AKT1 (0.43) ALDH1A1KDM4ELMNAGAAL3MBTL1
SCHEMBL62627 0.78 L3MBTL1 (0.50) ALDH1A1KDM4EGAASMN1; SMN2ADORA2A
SCHEMBL29373643 0.78 L3MBTL1 (0.50) ALDH1A1KDM4EGAASMN1; SMN2ADORA2A
SCHEMBL7897274 0.78 L3MBTL1 (0.53) ALDH1A1KDM4EGAASMN1; SMN2ADORA2A
SCHEMBL29732925 0.78 L3MBTL1 (0.53) ALDH1A1KDM4EGAASMN1; SMN2ADORA2A
SCHEMBL31467390 0.78 L3MBTL1 (0.50) ALDH1A1KDM4ELMNAGAASMN1; SMN2

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
US-20050003276-A1 Lithium polymer cell and manufacturing method thereof NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2005-01-06 US disclosed
EP-1460706-A1 LITHIUM POLYMER CELL AND MANUFACTURING METHOD THEREOF The Nippon Synthetic Chemical Industry Co., Ltd. (JP) 2004-09-22 EP disclosed
US-6268112-B1 ACRYLATED POLYURETHANES THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2001-07-31 US disclosed