SCHEMBL4073985

SCHEMBL4073985

CN(Cc1ccccc1)C(=O)[CH]CC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
ATM Q13315 1/20 0.45
SLC18A3 Q16572 1/20 0.43
POLB P06746 1/20 0.42
CPT2 P23786 1/20 0.41
CPT1A P50416 1/20 0.41
HPGD P15428 1/20 0.41
RIPK1 Q13546 1/20 0.41

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
SCHEMBL4067618 0.80 PKM (0.51) KMT2AMEN1NPC1RAB9AATM
SCHEMBL4287111 0.78 MAPK1 (0.59) KMT2AMEN1MAPK1L3MBTL1NPC1
SCHEMBL13889647 0.77 NPC1 (0.60) KMT2AMEN1MAPK1L3MBTL1NPC1
SCHEMBL4073987 0.76 NPC1 (0.64) KMT2AMEN1MAPK1L3MBTL1NPC1
SCHEMBL4064579 0.76 NPC1 (0.58) KMT2AMEN1NPC1RAB9ACA12
SCHEMBL19750331 0.75 MEN1 (0.64) KMT2AMEN1MAPK1L3MBTL1NPC1
SCHEMBL5529256 0.74 ATM (0.56) KMT2AMEN1MAPK1L3MBTL1NPC1
SCHEMBL5524502 0.73 ALOX5 (0.37) KMT2ACA12CA9HPGD
SCHEMBL4070760 0.72 RAB9A (0.64) KMT2AMEN1L3MBTL1NPC1RAB9A
SCHEMBL16894163 0.72 MAPK1 (0.59) KMT2AMEN1MAPK1L3MBTL1NPC1

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-1415986-B1 SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS BANYU PHARMA CO LTD (JP) 2009-04-08 EP disclosed
US-7205417-B2 Spiro compounds BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-04-17 US disclosed