SCHEMBL4686933

SCHEMBL4686933

Cc1cc([N+](=O)[O-])ccc1Oc1cccc(NC(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.65
MEN1 O00255 11/20 0.65
MAPT P10636 7/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
LMNA P02545 4/20 0.53
HTT P42858 3/20 0.50
MAPK1 P28482 2/20 0.50
FFAR1 O14842 1/20 0.50
TRPV1 Q8NER1 1/20 0.49
NPC1 O15118 2/20 0.48
POLB P06746 2/20 0.48
DDX3X O00571 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
HSP90AA1 P07900 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RAB9A P51151 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL4686928 1.00 KMT2A (0.65) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL4683941 0.88 KMT2A (0.62) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL4683934 0.88 KMT2A (0.62) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL4718987 0.87 KMT2A (0.58) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL4683454 0.86 MEN1 (0.62) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL4227907 0.84 MEN1 (0.55) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL4688634 0.84 MEN1 (0.56) KMT2AMEN1MAPTLMNAHTT
SCHEMBL4688637 0.84 MEN1 (0.56) KMT2AMEN1MAPTLMNAHTT
SCHEMBL5169615 0.83 FFAR1 (0.69) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL5169625 0.83 FFAR1 (0.69) KMT2AMEN1MAPTALDH1A1SMN1; SMN2

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-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO disclosed