SCHEMBL9778909

SCHEMBL9778909

Cc1cccc(OCCOc2ccc(C3OCCCO3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
DRD2 P14416 2/20 0.47
DRD4 P21917 2/20 0.47
DRD3 P35462 1/20 0.47
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
PPARD Q03181 2/20 0.41
FFAR1 O14842 1/20 0.41
PPARG P37231 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL9778697 0.86 KDM4E (0.44) L3MBTL1DRD2DRD4DRD3KDM4E
SCHEMBL9778602 0.84 MAOB (0.47) TDP1MAOAMAOB
SCHEMBL9778922 0.84 LMNA (0.47) DRD2DRD4KDM4EKMT2AMEN1
SCHEMBL9778740 0.83 DRD2 (0.43) L3MBTL1DRD2DRD4DRD3KDM4E
SCHEMBL9778889 0.83 MAOB (0.51) FFAR1MAOAMAOB
SCHEMBL9778708 0.82 SMN1; SMN2 (0.45) L3MBTL1TDP1KDM4EKMT2AMEN1
SCHEMBL9778856 0.81 KCNA3 (0.48) TDP1KMT2AMEN1MAOAMAOB
SCHEMBL9778641 0.80 MAOB (0.48) TDP1PPARDPPARGSMN1; SMN2MAOA
SCHEMBL9779134 0.80 KDM4E (0.45) KDM4ESMN1; SMN2MAPT
SCHEMBL9778777 0.79 DRD2 (0.43) L3MBTL1DRD2DRD4DRD3KDM4E

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
US-5063197-A Aromatic compound MITSUBISHI PAPER MILLS LIMITED (JP) 1991-11-05 US disclosed