SCHEMBL15039230

SCHEMBL15039230

Cc1nc2ccc(-c3ccc4nc(-c5cccc(C(C)(C)C)c5)[nH]c4c3)cc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.65
▸ RAB9A P51151 3/20 0.65
▸ MEN1 O00255 3/20 0.65
▸ POLB P06746 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.65
▸ KDM4E B2RXH2 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ MAPT P10636 2/20 0.60
▸ GFER P55789 2/20 0.60
▸ GAA P10253 2/20 0.60
▸ GLA P06280 1/20 0.60
▸ RXFP1 Q9HBX9 1/20 0.60
▸ SCD O00767 1/20 0.52
▸ NPBWR1 P48145 2/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ TP53 P04637 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ USP2 O75604 1/20 0.48

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
SCHEMBL21087571 0.85 NPC1 (0.67) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL35046 0.84 NPC1 (0.72) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL14665617 0.84 NPC1 (0.81) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL20921402 0.84 MEN1 (0.60) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL9915005 0.83 HDAC6 (0.49) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL34879 0.83 RAB9A (0.74) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL14346007 0.82 NPC1 (0.78) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL18708311 0.82 MEN1 (0.61) NPC1RAB9AMEN1POLBKMT2A
SCHEMBL24075254 0.81 GUSB (0.50) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL13634608 0.81 SCD (0.49) NPC1RAB9AMEN1POLBKMT2A

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-8802318-B2 Compound and composition including compound, with fuel cell, fuel cell electrode and fuel cell electrolyte membrane using same SAMSUNG ELECTRONICS CO., LTD. (KR) 2014-08-12 — — US disclosed
US-20130157168-A1 COMPOSITION, COMPOSITE PREPARED FROM THE COMPOSITION, ELECTRODE AND ELECTROLYTE MEMBRANE FOR FUEL CELL EACH INCLUDING THE SAME, METHOD OF PREPARING THE ELECTROLYTE MEMBRANE, AND FUEL CELL INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2013-06-20 — — US disclosed
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