SCHEMBL883907

SCHEMBL883907

NC(=O)c1cnccc1N1CCCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.58
CDK9 P50750 1/20 0.58
NPC1 O15118 1/20 0.58
MAPT P10636 3/20 0.55
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 1/20 0.55
THRB P10828 1/20 0.55
ALOX15 P16050 1/20 0.55
GFER P55789 1/20 0.55
YWHAG P61981 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B10 Q99714 1/20 0.55
HTT P42858 2/20 0.54
SIRT3 Q9NTG7 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PIM1 P11309 2/20 0.47
PIM3 Q86V86 2/20 0.47
PIM2 Q9P1W9 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
SCHEMBL3627591 0.98 NPC1 (0.61) CDC7CDK9NPC1MAPTKDM4E
SCHEMBL4309528 0.87 CDC7 (0.62) CDC7CDK9NPC1MAPTKDM4E
SCHEMBL31005773 0.86 CYP3A4 (0.52) CDC7CDK9NPC1MAPTKDM4E
SCHEMBL14663533 0.86 PIM1 (0.51) CDC7CDK9NPC1MAPTKDM4E
SCHEMBL353775 0.86 SIRT3 (0.46) CDC7CDK9NPC1MAPTKDM4E
SCHEMBL29402739 0.84 SIRT3 (0.45) CDC7CDK9NPC1MAPTKDM4E
Potassium Ion SCHEMBL18395818 0.81 HIPK2 (0.50) CDC7CDK9NPC1MAPTHTT
SCHEMBL23248642 0.79 PIM2 (0.47) SIRT3TDP1PIM1PIM3PIM2
SCHEMBL2490475 0.78 SIRT3 (0.42) CDC7CDK9NPC1MAPTKDM4E
SCHEMBL23708152 0.77 CDC7 (0.80) CDC7CDK9NPC1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2200440-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS Crestone, Inc. (US) 2010-06-30 EP claimed
WO-2009015208-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 WO claimed
WO-2024056099-A1 METTL3 INHIBITOR COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 北京华益健康药物研究中心 2024-03-21 WO disclosed
EP-2200440-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS Crestone, Inc. (US) 2010-06-30 EP disclosed
WO-2009015208-A1 ANTIBACTERIAL AMIDE AND SULFONAMIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 WO disclosed