SCHEMBL9574665

SCHEMBL9574665

O=C(OCc1ccccc1)c1ccc(OCc2cccc(COc3ccc(C(=O)OCc4ccccc4)cc3)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.66
PTPN1 P18031 1/20 0.66
KMT2A Q03164 2/20 0.65
SLC6A2 P23975 1/20 0.65
SLC6A3 Q01959 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
NR4A2 P43354 4/20 0.64
NR4A1 P22736 1/20 0.64
NR4A3 Q92570 1/20 0.64
LMNA P02545 1/20 0.64
MAOB P27338 1/20 0.60
PARP10 Q53GL7 1/20 0.60
SRD5A2 P31213 1/20 0.59
RXRA P19793 1/20 0.57
RXRB P28702 1/20 0.57
RXRG P48443 1/20 0.57
ALDH1A1 P00352 2/20 0.56
MAPT P10636 2/20 0.56
PLA2G4B P0C869 1/20 0.56
HPGD P15428 1/20 0.56

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
SCHEMBL50807 0.94 KMT2A (0.73) PTPRCPTPN1KMT2ASLC6A2SLC6A3
SCHEMBL9574756 0.92 KMT2A (0.71) PTPRCPTPN1KMT2ASLC6A2SLC6A3
SCHEMBL6029175 0.89 SLC6A2 (0.67) PTPRCPTPN1KMT2ASLC6A2SLC6A3
SCHEMBL5836718 0.89 SLC6A2 (0.67) PTPRCPTPN1KMT2ASLC6A2SLC6A3
SCHEMBL1944115 0.89 KMT2A (0.77) PTPRCPTPN1KMT2ASLC6A2SLC6A3
SCHEMBL51012 0.86 KMT2A (0.71) KMT2ASLC6A2SLC6A3TDP1NR4A2
SCHEMBL5085785 0.85 KMT2A (0.81) KMT2ASLC6A2SLC6A3TDP1LMNA
SCHEMBL11035112 0.85 NR4A2 (0.68) KMT2ASLC6A2SLC6A3TDP1NR4A2
SCHEMBL3235219 0.84 ALOX5 (0.61) KMT2ASLC6A2SLC6A3TDP1NR4A2
SCHEMBL312287 0.83 KMT2A (0.92) KMT2ASLC6A2SLC6A3TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63146846-A None JP disclosed
EP-0251795-B1 NEW COMPOUNDS AND THEIR APPLICATION Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1993-01-20 EP disclosed
US-4894359-A BIS(PHENOXYMETHYL)BENZENE DERIVATIVES KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1990-01-16 US disclosed
US-4855482-A New compounds and their application KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1989-08-08 US disclosed
JP-S63146846-A NOVEL COMPOUND AND USE THEREOF UENO SEIYAKU OYO KENKYUSHO:KK 1988-06-18 JP disclosed
EP-0251795-A2 New compounds and their application Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1988-01-07 EP disclosed