SCHEMBL2850466

SCHEMBL2850466

O=C(c1ccccc1Oc1ccccc1)C1C=Cc2cccc3cccc1c23

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.43
MAPT P10636 4/20 0.39
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
ALDH1A1 P00352 5/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
LMNA P02545 3/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 1/20 0.35
MITF O75030 1/20 0.35
POLB P06746 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
SCHEMBL962243 0.83 PARP10 (0.40) MAPTKDM4ETDP1SMN1; SMN2ALDH1A1
SCHEMBL27540525 0.78 TDP1 (0.45) MAPTKDM4ETDP1SMN1; SMN2MEN1
SCHEMBL27870906 0.78 EPHX1 (0.42) CTNNB1MAPTKDM4ETDP1SMN1; SMN2
Urea SCHEMBL27977094 0.75 EPHX1 (0.40) MAPTTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL12153022 0.74 HSD17B10 (0.34) MAPTKDM4ETDP1MEN1KMT2A
SCHEMBL1272762 0.73 HSD17B10 (0.32) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL547973 0.72 HSD17B10 (0.33) MEN1KMT2AHSD17B10
SCHEMBL27287008 0.71 MTNR1A (0.34) MAPTKDM4ETDP1MEN1KMT2A
SCHEMBL28276060 0.70 ATM (0.32) MEN1KMT2AALDH1A1HSD17B10POLB
Diphenylether SCHEMBL28046907 0.70 LTA4H (0.36) MAPTKDM4ETDP1TSHR

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
EP-1954747-B1 POLYMER ELECTROLYTE MEMBRANE COMPRISING COORDINATION POLYMER GEESTHACHT GKSS FORSCHUNG (DE) 2009-08-12 EP claimed
EP-2160782-A1 ELECTROLYTE MEMBRANE AND MEMBRANE ELECTRODE ASSEMBLY USING THE SAME Nissan Motor Co., Ltd. (JP) 2010-03-10 EP disclosed
WO-2009001511-A1 ELECTROLYTE MEMBRANE AND MEMBRANE ELECTRODE ASSEMBLY USING THE SAME NISSAN MOTOR CO., LTD. (JP) 2008-12-31 WO disclosed