SCHEMBL9846388

SCHEMBL9846388

O=C(O)C(=C(OCOc1ccccc1)Oc1ccccn1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 1/20 0.36
KDM4E B2RXH2 2/20 0.35
KDM6B O15054 1/20 0.35
KDM4A O75164 1/20 0.35
KDM5C P41229 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM2A Q9Y2K7 1/20 0.35
KDM3A Q9Y4C1 1/20 0.35
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALOX15 P16050 1/20 0.34
RAB9A P51151 2/20 0.34
PKM P14618 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL9846331 0.79 LMNA (0.43) KMT2AMEN1KDM4EKDM4AKDM4C
SCHEMBL9846380 0.72 MRGPRX4 (0.37) KMT2AKDM4EKDM4CLMNAHPGD
SCHEMBL9846384 0.70 SMN1; SMN2 (0.38) KMT2AMEN1KDM4ELMNAHPGD
SCHEMBL30532884 0.69 LMNA (0.53) KMT2AMEN1KDM4EKDM6BKDM4A
SCHEMBL2829058 0.69 LMNA (0.53) KMT2AMEN1KDM4EKDM6BKDM4A
SCHEMBL9846365 0.68 LMNA (0.45) KMT2AMEN1LMNAHPGDMAPT
SCHEMBL9846325 0.68 L3MBTL1 (0.41) KMT2AMEN1GAAKDM4ELMNA
SCHEMBL4965677 0.68 ALOX15 (0.56) KMT2AMEN1KDM4EHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL21811038 0.68 LMNA (0.51) KMT2AMEN1KDM4EKDM6BKDM4A
SCHEMBL11298814 0.68 GAA (0.39) KMT2AMEN1GAAKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415569-A2 Agrochemical compositions ZENECA LIMITED (GB) 1991-03-06 EP claimed