SCHEMBL3979015

SCHEMBL3979015

COC(=O)c1cc(OC)c(OC)c(Br)c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.57
POLB P06746 2/20 0.57
PTPN1 P18031 1/20 0.54
HSD17B10 Q99714 2/20 0.53
USP2 O75604 1/20 0.53
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HPGD P15428 3/20 0.47
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.43
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
TSHR P16473 2/20 0.42
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
APOBEC3A P31941 1/20 0.41
HTT P42858 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
CISD2 Q8N5K1 1/20 0.41

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
SCHEMBL437132 0.85 LCK (0.56) KDM4EPOLBPTPN1HSD17B10ALDH1A1
SCHEMBL30740970 0.85 LCK (0.56) KDM4EPOLBPTPN1HSD17B10ALDH1A1
SCHEMBL12135968 0.84 KDM4E (0.67) KDM4EPOLBPTPN1HSD17B10USP2
SCHEMBL2113203 0.83 KDM4E (0.53) KDM4EPOLBPTPN1HSD17B10USP2
SCHEMBL21635979 0.83 KDM4E (0.65) KDM4EPOLBPTPN1HSD17B10USP2
SCHEMBL20328547 0.82 KDM4E (0.56) KDM4EPOLBPTPN1HSD17B10USP2
SCHEMBL5658273 0.80 KDM4E (0.57) KDM4EPOLBPTPN1HSD17B10USP2
SCHEMBL438401 0.80 KDM4E (0.53) KDM4EPOLBPTPN1HSD17B10USP2
SCHEMBL644549 0.79 KDM4E (0.56) KDM4EPOLBPTPN1HSD17B10USP2
Hydrochloric Acid SCHEMBL28974048 0.79 KDM4E (0.55) KDM4EPOLBHSD17B10USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009051417-A2 PHENANTHRENE LACTAM DERIVATIVES HAVING ANTICANCER ACTIVITY AND METHOD FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-04-23 WO disclosed