SCHEMBL7971285

SCHEMBL7971285

COC(=O)c1ccc2ccc3ccc(OC)cc3c2c1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.50
MTNR1A P48039 5/20 0.49
PLA2G2A P14555 4/20 0.48
KDM4E B2RXH2 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
MAPT P10636 1/20 0.46
MTNR1B P49286 3/20 0.43
HTR2C P28335 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PLAU P00749 1/20 0.42

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
SCHEMBL7988819 0.81 KDM4E (0.51) MTNR1AKDM4EL3MBTL1TDP1ALDH1A1
SCHEMBL131009 0.77 NR4A2 (0.40) NR4A2MTNR1APLA2G2AKDM4ECYP1A2
SCHEMBL7558686 0.74 KDM4E (0.49) MTNR1APLA2G2AKDM4ECYP1A2ALDH1A1
SCHEMBL26882759 0.74 KDM4E (0.57) NR4A2PLA2G2AKDM4ECYP1A2CYP2D6
SCHEMBL28655389 0.74 PLA2G2A (0.55) NR4A2MTNR1APLA2G2AKDM4ECYP1A2
SCHEMBL382822 0.73 KDM4E (0.66) NR4A2PLA2G2AKDM4ECYP1A2CYP2D6
SCHEMBL130494 0.73 CA12 (0.61) KDM4ECYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2949877 0.72 KDM4E (0.64) NR4A2PLA2G2AKDM4ECYP1A2CYP2D6
SCHEMBL7988831 0.72 MEN1 (0.48) NR4A2KDM4ECYP1A2CYP2C19TDP1
SCHEMBL7985137 0.72 WDR5 (0.51) NR4A2KDM4ETDP1ALDH1A1HPGD

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
US-6300340-B1 USEFUL FOR THERAPY OF CANCER AND SOLID TUMORS ADIR ET COMPAGNIE (FR) 2001-10-09 US disclosed
US-6162822-A Bisimide compounds ADIR ET COMPAGNIE (FR) 2000-12-19 US disclosed
US-5854273-A Bisimide compounds ADIR ET COMPAGNIE (FR) 1998-12-29 US disclosed