SCHEMBL3789883

SCHEMBL3789883

O=c1oc2c(O)c(O)ccc2c2c1CCCC2

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.72
GLA P06280 12/20 0.72
GAA P10253 12/20 0.72
ALDH1A1 P00352 9/20 0.72
HPGD P15428 9/20 0.72
CASP1 P29466 5/20 0.72
CASP7 P55210 5/20 0.72
HSD17B10 Q99714 5/20 0.72
MAOA P21397 3/20 0.72
MAPK1 P28482 1/20 0.72
MAOB P27338 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.60
LMNA P02545 2/20 0.59
USP2 O75604 1/20 0.59
PKLR P30613 1/20 0.54
GALNT2 Q10471 1/20 0.54
GALNT1 Q10472 1/20 0.54
GALNT3 Q14435 1/20 0.54
GALNT10 Q86SR1 1/20 0.54
GALNT13 Q8IUC8 1/20 0.54

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
SCHEMBL31454896 0.81 ALDH1A1 (0.65) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL17615419 0.81 ERN1 (0.70) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL31454897 0.80 ALDH1A1 (0.63) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL17615420 0.80 ERN1 (0.68) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL4397355 0.80 MAOB (0.67) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL17615429 0.80 ERN1 (0.68) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL10791666 0.80 KDM4E (0.63) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL12998174 0.79 STS (0.55) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL10790707 0.79 KDM4E (0.61) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL31454856 0.78 KDM4E (0.61) KDM4EGLAGAAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838186-B2 Photoconductors containing charge transport chelating components XEROX CORPORATION (US) 2010-11-23 US claimed
US-20080286670-A1 Photoconductors containing charge transport chelating components XEROX CORPORATION 2008-11-20 US claimed
US-7838186-B2 Photoconductors containing charge transport chelating components XEROX CORPORATION (US) 2010-11-23 US disclosed
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20080286670-A1 Photoconductors containing charge transport chelating components XEROX CORPORATION 2008-11-20 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed