SCHEMBL10945675

SCHEMBL10945675

CN(C)C(C)(C)C(=O)c1ccc2c(c1)c(=O)c1ccccc1n2C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
ATM Q13315 2/20 0.45
NPC1 O15118 6/20 0.44
RAB9A P51151 6/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HCRTR1 O43613 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
HTT P42858 2/20 0.42
MAPT P10636 1/20 0.42
POLB P06746 2/20 0.41
NR2F2 P24468 1/20 0.41
GAA P10253 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CYP2C19 P33261 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
NPY5R Q15761 1/20 0.39

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
SCHEMBL10944265 0.97 KDM4E (0.51) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10946256 0.93 KDM4E (0.43) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10942976 0.91 KDM4E (0.43) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10945913 0.85 KDM4E (0.55) KDM4EATMNPC1RAB9AMEN1
SCHEMBL11207792 0.83 KDM4E (0.55) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10943793 0.82 KDM4E (0.51) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10945099 0.80 KDM4E (0.51) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10943228 0.80 KDM4E (0.51) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10943731 0.79 KDM4E (0.48) KDM4EATMNPC1RAB9AMEN1
SCHEMBL10948436 0.78 KDM4E (0.46) KDM4EATMNPC1RAB9AMEN1

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-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 US disclosed