SCHEMBL9846273

SCHEMBL9846273

COC(Oc1ccncn1)=C(C(=O)OOc1ccccc1C)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
GFER P55789 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
MAPK14 Q16539 1/20 0.33
NOTUM Q6P988 4/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL9846369 0.89 KMT2A (0.33) POLBKMT2AMEN1PKMHTT
SCHEMBL9846384 0.74 SMN1; SMN2 (0.38) POLBKMT2AMEN1PKMHTT
SCHEMBL9007828 0.66 SMN1; SMN2 (0.56) KMT2AMEN1HTTNPC1RAB9A
SCHEMBL9846380 0.65 MRGPRX4 (0.37) POLBKMT2APKMHTTGFER
SCHEMBL6204759 0.65 TDP1 (0.51) POLBKMT2AMEN1NPC1RAB9A
SCHEMBL94312 0.64 LMNA (0.57) POLBKMT2AMEN1PKMNPC1
SCHEMBL6648327 0.64 P2RX7 (0.41) HTTLMNAALDH1A1HPGDMAPK14
SCHEMBL9846325 0.64 L3MBTL1 (0.41) POLBKMT2AMEN1HTTNPC1
SCHEMBL29598167 0.63 LMNA (0.39) POLBKMT2AMEN1NPC1RAB9A
SCHEMBL3657194 0.62 HSP90AA1 (0.41) KMT2AMEN1PKMHTTGFER

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 disclosed