SCHEMBL6169984

SCHEMBL6169984

COC(=O)c1cc(OC(C)=O)c2cc(OCCOC(C)=O)ccc2c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.40
MAPT P10636 2/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 1/20 0.40
PLA2G2A P14555 4/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
P2RY12 Q9H244 1/20 0.38
MAPK8 P45983 1/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 2/20 0.37
NPC1 O15118 1/20 0.37
STAT1 P42224 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AXL P30530 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL6170794 0.90 PLA2G2A (0.44) RAB9AMAPTPPARGPPARAPLA2G2A
SCHEMBL8510685 0.86 PLA2G2A (0.51) MAPTPLA2G2AMAPK8KDM4EALDH1A1
SCHEMBL9899016 0.81 NR4A2 (0.50) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL1009498 0.81 TSHR (0.48) MAPTMAPK8KDM4EALDH1A1KMT2A
SCHEMBL17733151 0.80 ALDH1A1 (0.49) MAPTPPARGKDM4EALDH1A1KMT2A
SCHEMBL9899615 0.80 PLA2G2A (0.49) MAPTPLA2G2AMAPK8KDM4EALDH1A1
SCHEMBL3151462 0.79 MAPK8 (0.47) MAPK8ALDH1A1KMT2AL3MBTL1
SCHEMBL6383895 0.79 BACE1 (0.51) MAPTPLA2G2AKDM4EALDH1A1HPGD
SCHEMBL9899201 0.79 NR4A2 (0.46) MAPTMAPK8KDM4EALDH1A1KMT2A
SCHEMBL31435276 0.78 KDM4E (0.46) RAB9AMAPTKDM4EALDH1A1NPC1

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
EP-1112263-B1 POLYMERIZABLE POLYALKOXYLATED NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2005-06-08 EP disclosed
EP-1112263-A1 POLYMERIZABLE POLYALKOXYLATED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2001-07-04 EP disclosed
US-6113814-A PHOTOCHROMIC; END-CAPPED WITH A POLYMERIZABLE GROUP. TRANSITIONS OPTICAL, INC. (US) 2000-09-05 US disclosed
WO-2000015629-A1 POLYMERIZABLE POLYALKOXYLATED NAPHTHOPYRANS PPG INDUSTRIES OHIO, INC. (US) 2000-03-23 WO disclosed