SCHEMBL7119982

SCHEMBL7119982

O=C(Oc1ccccc1)c1c(-c2ccccc2)ccc(O)c1Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
NSD2 O96028 1/20 0.43
KDM4E B2RXH2 3/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
PTGS2 P35354 1/20 0.39
MAPT P10636 6/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
SLC6A2 P23975 1/20 0.39
PDE4A P27815 1/20 0.39
ADRA1A P35348 1/20 0.39
KDR P35968 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL7122378 0.87 HSD17B10 (0.44) HSD17B10HPGDALOX15NSD2KDM4E
SCHEMBL7116818 0.87 HSD17B10 (0.44) HSD17B10HPGDALOX15NSD2KDM4E
SCHEMBL7117874 0.83 EGFR (0.43) HSD17B10HPGDALOX15NSD2KDM4E
SCHEMBL7157097 0.78 HSD17B10 (0.47) HSD17B10HPGDALOX15KDM4EPTGS2
SCHEMBL983374 0.74 PDE4B (0.46) HSD17B10HPGDKDM4ETHRATHRB
SCHEMBL7119986 0.74 HSD17B10 (0.46) HSD17B10HPGDALOX15NSD2KDM4E
SCHEMBL7121111 0.73 EGFR (0.52) HSD17B10HPGDKDM4ELMNACYP3A4
SCHEMBL7116141 0.72 EGFR (0.49) HSD17B10HPGDKDM4EPTGS2MAPT
SCHEMBL50363 0.72 MAPT (0.56) HSD17B10HPGDALOX15KDM4EPTGS2
SCHEMBL4385363 0.72 HSD17B10 (0.69) HSD17B10HPGDALOX15NSD2KDM4E

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-1016648-B1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES ASAHI CHEMICAL IND (JP) 2003-05-14 EP disclosed
US-6262210-B1 TRANSESTERIFYING DIALKYL CARBONATE, ALKYL ARYL CARBONATE OR MIXTURE WITH AROMATIC MONOHYDROXY COMPOUND IN PRESENCE OF METAL CONTAINING CATALYST TO OBTAIN HIGH BOILING POINT REACTION MIXTURE CONTAINING AROMATIC CARBONATE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-07-17 US disclosed
EP-1016648-A1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-07-05 EP disclosed