SCHEMBL6004289

SCHEMBL6004289

CCc1ccc(O)c(-c2ncccc2O)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
GAA P10253 2/20 0.43
HSD17B10 Q99714 2/20 0.43
GLA P06280 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 2/20 0.41
IDO1 P14902 1/20 0.40
COMT P21964 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MMP2 P08253 1/20 0.39
CHRM1 P11229 1/20 0.39
TSHR P16473 1/20 0.39
ADRA1A P35348 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HTT P42858 2/20 0.35
SLC6A2 P23975 1/20 0.35

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
SCHEMBL6004731 0.84 IDO1 (0.37) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL3947063 0.80 KDM4E (0.44) KDM4EGAAKMT2AL3MBTL1METAP1
SCHEMBL29769309 0.77 KDM4E (0.55) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL687180 0.77 KDM4E (0.55) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL6002898 0.76 CYP2A6 (0.42) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL22165268 0.75 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL3893914 0.72 KDM4E (0.42) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL3943759 0.70 CCR1 (0.47) KDM4EALDH1A1HSD17B10KMT2AMETAP2
SCHEMBL28897793 0.70 ALDH1A1 (0.50) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL3891690 0.69 KDM4E (0.47) KDM4EALDH1A1HPGDGAAHSD17B10

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
EP-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed