SCHEMBL6906648

SCHEMBL6906648

CC1c2cc(O)ccc2Oc2ccc(O)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.44
HPGD P15428 6/20 0.44
GLA P06280 1/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 2/20 0.42
GAA P10253 1/20 0.42
DYRK1A Q13627 1/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 1/20 0.40
CYP3A4 P08684 3/20 0.39
MAPKAPK2 P49137 1/20 0.38
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
XDH P47989 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
DRD3 P35462 3/20 0.35
CYP1A2 P05177 2/20 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
SCHEMBL17797155 0.84 ALDH1A1 (0.47) ALDH1A1HPGDGLAMAPTMEN1
SCHEMBL9810672 0.83 MEN1 (0.44) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL31545095 0.79 MEN1 (0.48) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL6905352 0.78 MAPKAPK2 (0.44) ALDH1A1HPGDGLAMAPTMEN1
SCHEMBL6905793 0.78 ESR1 (0.44) ALDH1A1HPGDGLAMAPTMEN1
SCHEMBL10262075 0.75 ALDH1A1 (0.46) ALDH1A1HPGDGLAMAPTMEN1
SCHEMBL1658268 0.75 DYRK1A (0.62) ALDH1A1HPGDGLAMAPTMEN1
SCHEMBL29742702 0.75 DYRK1A (0.62) ALDH1A1HPGDGLAMAPTMEN1
SCHEMBL9633548 0.74 AHR (0.54) DRD3DRD2DRD4MAPK1
SCHEMBL13899934 0.72 PTGES (0.46) DYRK1AESR1ESR2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed