SCHEMBL9618797

SCHEMBL9618797

O=C(O)c1ccc2c(-c3c(O)ccc4ccccc34)c(O)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 3/20 0.54
PTPN1 P18031 1/20 0.54
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
WDR5 P61964 1/20 0.50
THRB P10828 1/20 0.50
PKM P14618 1/20 0.50
GRIN2D O15399 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2C Q14957 1/20 0.50
HKDC1 Q2TB90 1/20 0.49
SOS1 Q07889 1/20 0.49
KDM4E B2RXH2 3/20 0.47
GAA P10253 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL9618790 0.92 KDM4E (0.55) MAPTALDH1A1HPGDPTPN1GRIN2D
SCHEMBL1434509 0.87 ESR1 (0.60) MAPTALDH1A1HPGDPTPN1GRIN2D
SCHEMBL9618724 0.86 GRIN2D (0.47) MAPTALDH1A1HPGDPTPN1MEN1
SCHEMBL2469662 0.86 ALDH1A1 (0.70) MAPTALDH1A1HPGDPTPN1MEN1
SCHEMBL10484311 0.84 ALDH1A1 (0.68) MAPTALDH1A1HPGDPTPN1MEN1
Bromide SCHEMBL7585583 0.84 ALDH1A1 (0.68) MAPTALDH1A1HPGDPTPN1MEN1
SCHEMBL24891572 0.83 KDM4E (0.50) MAPTALDH1A1HPGDPTPN1MEN1
SCHEMBL23515350 0.83 HSD17B10 (0.65) MAPTALDH1A1HPGDPTPN1MEN1
SCHEMBL29625752 0.83 HSD17B10 (0.65) MAPTALDH1A1HPGDPTPN1MEN1
SCHEMBL24891599 0.82 ESR1 (0.48) MAPTALDH1A1HPGDPTPN1MEN1

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
US-4804415-A COUPLING AROMATIC DIAZONIUM COMPOUND WITH 3-HYDROXY-2-NAPHTHOIC AICD AND BINAPHTHOL KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1989-02-14 US claimed
EP-0259007-B1 PROCESS FOR PRODUCING AZO PIGMENT Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-01-02 EP disclosed
US-4804415-A COUPLING AROMATIC DIAZONIUM COMPOUND WITH 3-HYDROXY-2-NAPHTHOIC AICD AND BINAPHTHOL KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1989-02-14 US disclosed
EP-0259007-A1 Process for producing azo pigment Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1988-03-09 EP disclosed