SCHEMBL8425249

SCHEMBL8425249

CCc1ccccc1N.CCc1ccccc1NC=C1C(=O)N(c2ccc(Cl)cc2)N=C1C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
AMY1A P0DUB6 16/20 0.47
MAPT P10636 2/20 0.42
MAPK1 P28482 2/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL8425246 1.00 L3MBTL1 (0.49) L3MBTL1MEN1KMT2AAMY1AMAPT
SCHEMBL6951495 0.95 L3MBTL1 (0.54) L3MBTL1MEN1KMT2AAMY1AMAPT
SCHEMBL6951498 0.95 L3MBTL1 (0.54) L3MBTL1MEN1KMT2AAMY1AMAPT
SCHEMBL8425443 0.87 KAT8 (0.55) L3MBTL1MEN1KMT2AMAPTTDP1
SCHEMBL8425442 0.87 KAT8 (0.55) L3MBTL1MEN1KMT2AMAPTTDP1
SCHEMBL8425597 0.86 KAT8 (0.40) L3MBTL1MEN1KMT2AMAPTMAPK1
SCHEMBL8425593 0.86 KAT8 (0.40) L3MBTL1MEN1KMT2AMAPTMAPK1
SCHEMBL8427580 0.85 KDM4E (0.38) L3MBTL1MEN1KMT2AMAPTMAPK1
SCHEMBL8427562 0.85 KAT8 (0.41) L3MBTL1MEN1KMT2AMAPTMAPK1
SCHEMBL8427578 0.85 KDM4E (0.38) L3MBTL1MEN1KMT2AMAPTMAPK1

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
US-5869516-A 4-(arylaminomethylene)-2,4-dihydro-3-pyrazolones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-02-09 US disclosed