SCHEMBL7553889

SCHEMBL7553889

CC1(C)Oc2ccccc2C(OCCc2ccccc2)=C1O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.38
MAOA P21397 6/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
IDO1 P14902 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
FFAR1 O14842 1/20 0.35
P2RX4 Q99571 1/20 0.35
KMT2A Q03164 1/20 0.34
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33

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
SCHEMBL9354700 0.67 MAPT (0.33) SMN1; SMN2KMT2A
SCHEMBL9752735 0.64 OPRD1 (0.33) IDO1
SCHEMBL8482855 0.62 CTDSP1 (0.35) SMN1; SMN2IDO1RAB9A
SCHEMBL13009960 0.60 IDO1 (0.34) IDO1
SCHEMBL1833211 0.60 LMNA (0.68) NPC1RAB9AFFAR1
SCHEMBL1833210 0.60 GAA (0.67) IDO1NPC1RAB9AFFAR1
SCHEMBL30408898 0.60 GAA (0.67) IDO1NPC1RAB9AFFAR1
SCHEMBL17912813 0.60 CYP11B1 (0.56) SMN1; SMN2IDO1NPC1RAB9AFFAR1
SCHEMBL1070131 0.60 NPC1 (0.73) MAOBMAOANPC1RAB9AFFAR1
SCHEMBL9456979 0.60 NPC1 (0.80) MAOBMAOANPC1RAB9AFFAR1

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
EP-1218367-A1 4-OXYBENZOPYRAN DERIVATIVE Nissan Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001025224-A1 4-OXYBENZOPYRAN DERIVATIVE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2001-04-12 WO disclosed