SCHEMBL4527922

SCHEMBL4527922

Cc1c[nH]cc1C(=O)Oc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
KDM4E B2RXH2 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
HSD17B10 Q99714 2/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
NR4A2 P43354 1/20 0.53
NOTUM Q6P988 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 2/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
TBXA2R P21731 1/20 0.45
SLC6A2 P23975 1/20 0.45

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
SCHEMBL4537376 0.86 MAPT (0.45) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL4537374 0.86 MAPT (0.45) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL4363059 0.79 HPGD (0.58) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL1254116 0.79 KMT2A (0.64) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL69868 0.76 HSD17B10 (0.76) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL29437924 0.76 HSD17B10 (0.76) MAPTKDM4ETDP1HSD17B10HPGD
Trimethylammonium SCHEMBL60750 0.75 KMT2A (0.59) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL30631651 0.75 MAPT (0.59) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL10884650 0.75 HSD17B10 (0.53) MAPTKDM4ETDP1HSD17B10HPGD
SCHEMBL10778989 0.75 MAPT (0.59) MAPTKDM4ETDP1HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090014920-A1 POLYMER FILAMENTS MASSEY UNIVERSITY (NZ) 2009-01-15 US claimed
WO-2006001719-A1 POLYMER FILAMENTS MASSEY UNIVERSITY (NZ) 2006-01-05 WO claimed
US-20090014920-A1 POLYMER FILAMENTS MASSEY UNIVERSITY (NZ) 2009-01-15 US disclosed
WO-2006001719-A1 POLYMER FILAMENTS MASSEY UNIVERSITY (NZ) 2006-01-05 WO disclosed
EP-0332704-B1 PROCESS FOR PRODUCING CONDUCTIVE POLYMER FILM NIPPON SODA CO (JP) 1994-12-21 EP disclosed
US-5306443-A Dissolving monomer with metal containing oxidizing agent in sufficient solvent to prevent polymerization; removal of solvent NIPPON SODA CO., LTD. (JP) 1994-04-26 US disclosed
EP-0332704-A1 PROCESS FOR PRODUCING CONDUCTIVE POLYMER FILM NIPPON SODA CO., LTD. (JP) 1989-09-20 EP disclosed