SCHEMBL7050574

SCHEMBL7050574

COc1cccc2cc(C(=O)c3ccncc3)oc12

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.78
NPC1 O15118 2/20 0.78
SMN1; SMN2 Q16637 2/20 0.78
KMT2A Q03164 2/20 0.78
MEN1 O00255 1/20 0.78
ALDH1A1 P00352 4/20 0.74
MAPT P10636 3/20 0.74
HTT P42858 2/20 0.74
L3MBTL1 Q9Y468 1/20 0.67
LMNA P02545 2/20 0.64
RECQL P46063 1/20 0.64
KDM4E B2RXH2 1/20 0.53
NPSR1 Q6W5P4 2/20 0.53
RXFP1 Q9HBX9 2/20 0.53
TSHR P16473 1/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA3 P07451 1/20 0.50
CA4 P22748 1/20 0.50

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
SCHEMBL5723065 0.88 RAB9A (1.00) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL16581094 0.84 RAB9A (0.79) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL11107533 0.84 RAB9A (0.79) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL6837407 0.80 RAB9A (0.67) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL978037 0.79 LMNA (0.77) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL219813 0.79 LMNA (1.00) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL7053276 0.79 RAB9A (0.62) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL5584678 0.77 LMNA (0.75) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL3614366 0.77 LMNA (0.75) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL4209809 0.77 LMNA (0.75) RAB9ANPC1SMN1; SMN2KMT2AMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901482-B1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-05-02 EP disclosed
US-5972936-A Benzofuran carboxamides and their therapeutic use DARWIN DISCOVER LIMITED (GB) 1999-10-26 US disclosed
US-5925636-A Benzofuran carboxamides and their therapeutic use DARWIN DISCOVERY LIMITED (GB) 1999-07-20 US disclosed
EP-0901482-A1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 1999-03-17 EP disclosed
WO-1997044337-A1 BENZOFURAN CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1997-11-27 WO disclosed