SCHEMBL18683086

SCHEMBL18683086

O=Cc1c(OCc2ccccc2)ccc2[nH]ccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.62
RAB9A P51151 4/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
MAPT P10636 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CCNB2 O95067 1/20 0.41
CDK1 P06493 1/20 0.41
CDK4 P11802 1/20 0.41
CCNB1 P14635 1/20 0.41
CCND1 P24385 1/20 0.41
CCNB3 Q8WWL7 1/20 0.41
NSD2 O96028 1/20 0.41
ABL1 P00519 1/20 0.41

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
SCHEMBL1994140 0.78 DRD2 (0.43) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
SCHEMBL8546338 0.78 MAPK14 (0.43) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
SCHEMBL30390986 0.78 L3MBTL1 (0.56) L3MBTL1MAPTSMN1; SMN2DRD2DRD4
SCHEMBL3909627 0.78 DRD2 (0.43) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
SCHEMBL4345200 0.77 NPC1 (1.00) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
SCHEMBL29415608 0.76 DRD4 (0.63) L3MBTL1MAPTDRD2DRD4DRD3
SCHEMBL746079 0.76 DRD4 (0.63) L3MBTL1MAPTDRD2DRD4DRD3
SCHEMBL3897534 0.76 POLB (0.43) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
SCHEMBL1400228 0.76 PPARD (0.44) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
SCHEMBL3923636 0.75 MAPT (0.66) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2

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
EP-2855456-B1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2017-03-29 EP disclosed