SCHEMBL7945854

SCHEMBL7945854

[CH2]CCCCNC(=O)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.83
MEN1 O00255 2/20 0.83
SMN1; SMN2 Q16637 2/20 0.71
POLB P06746 1/20 0.71
MAPK1 P28482 1/20 0.71
SLC29A1 Q99808 1/20 0.61
BRD4 O60885 1/20 0.56
NPC1 O15118 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
PKM P14618 1/20 0.55

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
SCHEMBL7956500 0.99 KMT2A (0.86) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL7956522 0.95 KMT2A (0.80) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL7945842 0.89 KMT2A (0.74) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL27516231 0.87 KMT2A (0.85) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL20339052 0.85 KMT2A (0.88) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL20339060 0.85 KMT2A (0.88) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL20340722 0.85 KMT2A (0.88) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL2925817 0.85 KMT2A (0.82) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL11878483 0.84 POLB (0.97) KMT2AMEN1SMN1; SMN2POLBMAPK1
SCHEMBL30063662 0.84 KMT2A (0.86) KMT2AMEN1SMN1; SMN2POLBMAPK1

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-6245779-B1 ANALGESICS; ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2001-06-12 US disclosed
EP-0997463-A1 NAPHTHYRIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-05-03 EP disclosed