SCHEMBL4386355

SCHEMBL4386355

O=C(O)c1cc(Br)ccc1NC(=O)c1cc2ccccc2oc1=O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.77
▸ RAB9A P51151 4/20 0.77
▸ KMT2A Q03164 2/20 0.77
▸ MEN1 O00255 1/20 0.77
▸ F12 P00748 2/20 0.65
▸ MAOB P27338 9/20 0.64
▸ MAOA P21397 5/20 0.64
▸ BACE1 P56817 3/20 0.62
▸ CA12 O43570 2/20 0.62
▸ CA1 P00915 2/20 0.62
▸ CA4 P22748 2/20 0.62
▸ CA5A P35218 2/20 0.62
▸ CA7 P43166 2/20 0.62
▸ CA5B Q9Y2D0 2/20 0.62
▸ CA2 P00918 1/20 0.62
▸ CA3 P07451 1/20 0.62
▸ TSHR P16473 1/20 0.62
▸ CA6 P23280 1/20 0.62
▸ CA9 Q16790 1/20 0.62
▸ GPR35 Q9HC97 1/20 0.62

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
SCHEMBL6817708 0.85 RAB9A (0.63) NPC1RAB9AKMT2AMEN1TSHR
SCHEMBL831792 0.79 MAOB (1.00) NPC1RAB9AF12MAOBMAOA
Coumarin-3-Carboxylic Acid SCHEMBL29414591 0.78 MAOB (1.00) NPC1RAB9AKMT2AMEN1F12
Coumarin-3-Carboxylic Acid SCHEMBL93571 0.78 MAOB (1.00) NPC1RAB9AKMT2AMEN1F12
SCHEMBL11462954 0.77 MAOB (0.91) NPC1RAB9AF12MAOBMAOA
SCHEMBL1307732 0.77 GFER (0.76) RAB9AKMT2AMEN1BACE1TSHR
Coumarin-3-Carboxylic Acid SCHEMBL31756871 0.77 MAOB (0.96) NPC1RAB9AKMT2AMEN1F12
Coumarin-3-Carboxylic Acid SCHEMBL31756872 0.77 MAOB (0.96) NPC1RAB9AKMT2AMEN1F12
Coumarin-3-Carboxylic Acid SCHEMBL28645274 0.77 MAOB (0.96) NPC1RAB9AKMT2AMEN1F12
Coumarin-3-Carboxylic Acid SCHEMBL7862224 0.77 MAOB (0.96) NPC1RAB9AKMT2AMEN1F12

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
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