SCHEMBL20524326

SCHEMBL20524326

Brc1c[nH]nc1CCO[C@H]1CCCCO1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ADORA3 P0DMS8 1/20 0.33
CA12 O43570 3/20 0.31
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
CA9 Q16790 3/20 0.31
CHEK1 O14757 1/20 0.30

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
SCHEMBL19635447 0.75 KDM4C (0.43) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL31065932 0.74 KDM4C (0.44) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL28796337 0.74 NPC1 (0.50) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL29749639 0.74 NPC1 (0.50) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL24669516 0.73 KDM4C (0.51) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL772902 0.72 KDM4C (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL30049433 0.72 KDM4C (0.50) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL2633488 0.72 KDM4C (0.56) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL29447734 0.72 KDM4C (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL4078714 0.71 KDM4C (0.49) KDM4CL3MBTL1NPC1RAB9AMEN1

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-3601284-A1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 H. Hoffnabb-La Roche Ag (CH) 2020-02-05 EP disclosed
WO-2018183956-A1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 GENENTECH, INC. (US) 2018-10-04 WO disclosed