SCHEMBL11039464

SCHEMBL11039464

CCOc1c(C)c2cc(O)c(O)cc2oc1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.47
GPR35 Q9HC97 1/20 0.46
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 6/20 0.46
HPGD P15428 5/20 0.46
GAA P10253 4/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPT P10636 4/20 0.46
MCL1 Q07820 3/20 0.46
BLM P54132 3/20 0.46
AKR1B1 P15121 2/20 0.46
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
RECQL P46063 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
AKR1B10 O60218 1/20 0.46
USP2 O75604 1/20 0.46
ABL1 P00519 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL27817043 0.82 HSD17B3 (0.65) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL27617272 0.78 HSD17B3 (0.61) MAOBGPR35ALDH1A1KDM4EHPGD
SCHEMBL9956829 0.75 KDM4E (0.50) ALDH1A1KDM4EHPGDGAAKMT2A
SCHEMBL6487039 0.74 KDM4E (0.65) GPR35ALDH1A1KDM4EHPGDGAA
SCHEMBL8374891 0.74 HSD17B3 (0.61) GPR35ALDH1A1KDM4EHPGDGAA
SCHEMBL7798964 0.72 KDM4E (0.74) ALDH1A1KDM4EHPGDGAAMEN1
SCHEMBL6276869 0.72 NQO1 (0.57) ALDH1A1KDM4EHPGDGAAMEN1
SCHEMBL10743403 0.71 GPR35 (0.64) GPR35ALDH1A1KDM4EHPGDMEN1
SCHEMBL8489395 0.71 ALDH1A1 (0.59) MAOBALDH1A1KDM4EHPGDGAA
SCHEMBL7795084 0.70 GPR35 (0.54) GPR35ALDH1A1KDM4EHPGDGAA

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
EP-0031202-B1 NEW POLYESTER COMPOSITIONS; SHAPED ARTICLES OBTAINED FROM THEM AND PROCESSES FOR PREPARING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-10-03 EP disclosed
US-4347350-A Polyester compositions containing residues of dihydroxyalkoxy coumarins IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-08-31 US disclosed
EP-0031202-A2 New polyester compositions; shaped articles obtained from them and processes for preparing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-07-01 EP disclosed