SCHEMBL4397355

SCHEMBL4397355

COc1ccc2c3c(c(=O)oc2c1O)CCCC3

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.67
ALDH1A1 P00352 8/20 0.64
HPGD P15428 7/20 0.64
MAOA P21397 6/20 0.63
MIF P14174 1/20 0.62
KDM4E B2RXH2 6/20 0.61
HSD17B10 Q99714 5/20 0.61
TSHR P16473 3/20 0.61
GBA1 P04062 1/20 0.60
MAPK1 P28482 3/20 0.59
GLA P06280 1/20 0.59
GAA P10253 1/20 0.59
CASP1 P29466 1/20 0.59
CASP7 P55210 1/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
NPSR1 Q6W5P4 1/20 0.59
FHIT P49789 2/20 0.56
MCL1 Q07820 1/20 0.56
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4390839 0.84 ALDH1A1 (0.78) MAOBALDH1A1HPGDMAOAMIF
SCHEMBL12998174 0.81 STS (0.55) MAOBALDH1A1HPGDMAOAKDM4E
SCHEMBL3789883 0.80 KDM4E (0.72) MAOBALDH1A1HPGDMAOAKDM4E
SCHEMBL9747411 0.75 MAOA (0.65) MAOBALDH1A1HPGDMAOAKDM4E
SCHEMBL4562737 0.74 ALDH1A1 (0.73) MAOBALDH1A1HPGDMAOAMIF
SCHEMBL4711135 0.72 HSD17B10 (0.58) MAOBALDH1A1HPGDMAOAMIF
SCHEMBL14916645 0.72 MAOA (0.50) MAOBALDH1A1HPGDMAOAMIF
SCHEMBL15984891 0.72 MCL1 (1.00) MAOBALDH1A1HPGDMAOAKDM4E
SCHEMBL4759826 0.71 ALDH1A1 (0.69) MAOBALDH1A1HPGDMAOAKDM4E
SCHEMBL10791666 0.71 KDM4E (0.63) MAOBALDH1A1HPGDMAOAKDM4E

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-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed