SCHEMBL7119986

SCHEMBL7119986

O=C(Oc1ccccc1)c1c(Oc2ccccc2O)cccc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.46
HPGD P15428 3/20 0.46
ALOX15 P16050 2/20 0.46
KDM4E B2RXH2 3/20 0.43
NSD2 O96028 1/20 0.41
MAPT P10636 6/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CHRM1 P11229 1/20 0.40
TBXA2R P21731 1/20 0.40
SLC6A2 P23975 1/20 0.40
PDE4A P27815 1/20 0.40
ADRA1A P35348 1/20 0.40
KDR P35968 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ALDH1A1 P00352 3/20 0.40

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
SCHEMBL7119978 0.77 HSD17B10 (0.61) HSD17B10HPGDALOX15KDM4ENSD2
SCHEMBL11766953 0.77 HSD17B10 (0.68) HSD17B10HPGDALOX15KDM4ENSD2
SCHEMBL50363 0.76 MAPT (0.56) HSD17B10HPGDALOX15KDM4EMAPT
SCHEMBL27410294 0.75 MAPT (0.47) HSD17B10HPGDALOX15KDM4EMAPT
SCHEMBL27981031 0.75 NCOA1 (0.58) HSD17B10HPGDTP53ALDH1A1BCL2L1
SCHEMBL1838198 0.75 ALDH1A1 (0.58) HSD17B10HPGDKDM4EMAPTSMN1; SMN2
2-Phenylphenol SCHEMBL11133679 0.75 HPGD (0.71) HSD17B10HPGDALOX15MAPTSMN1; SMN2
SCHEMBL11015871 0.75 HNF4A (0.53) HSD17B10HPGDALOX15KDM4EMAPT
SCHEMBL7119982 0.74 HSD17B10 (0.45) HSD17B10HPGDALOX15KDM4ENSD2
SCHEMBL5798820 0.74 NCOA1 (0.49) HSD17B10KDM4ESMN1; SMN2LMNATDP1

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