SCHEMBL8931765

SCHEMBL8931765

CCC(C(O)c1ccc(Cl)cc1)n1ncn(-c2ccc(N3CCN(c4cccc(O)c4)CC3)nc2)c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.60
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP3A4 P08684 2/20 0.38
MCHR1 Q99705 4/20 0.38
DRD2 P14416 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KCNH2 Q12809 2/20 0.35
CNR1 P21554 1/20 0.35
ENPP2 Q13822 1/20 0.34
IGF1R P08069 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
RECQL P46063 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
SCHEMBL9279579 1.00 DGAT1 (0.60) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931684 0.91 DGAT1 (0.60) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931704 0.91 DGAT1 (0.57) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL9285138 0.91 DGAT1 (0.57) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8809855 0.87 DGAT1 (0.57) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL8931656 0.87 DGAT1 (0.54) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL9285996 0.87 DGAT1 (0.54) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL9285627 0.86 DGAT1 (0.55) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL9285624 0.86 DGAT1 (0.55) DGAT1MAPTLMNAKDM4EALDH1A1
SCHEMBL7717362 0.85 DGAT1 (0.61) DGAT1MAPTLMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650411-A BACTERICIDES FOR HELICOBACTER DISEASES AND BACTERIA RESISTANCE JANSSEN PHARMACEUTICA N.V. (BE) 1997-07-22 US claimed
EP-0684821-A1 SUBSTITUTED AZOLONE DERIVATIVES FOR TREATING DISEASES CAUSED BY HELICOBACTER JANSSEN PHARMACEUTICA N.V. (BE) 1995-12-06 EP claimed
WO-1994018978-A1 SUBSTITUTED AZOLONE DERIVATIVES FOR TREATING DISEASES CAUSED BY HELICOBACTER JANSSEN PHARMACEUTICA N.V. (BE) 1994-09-01 WO claimed
US-5650411-A BACTERICIDES FOR HELICOBACTER DISEASES AND BACTERIA RESISTANCE JANSSEN PHARMACEUTICA N.V. (BE) 1997-07-22 US disclosed
EP-0684821-A1 SUBSTITUTED AZOLONE DERIVATIVES FOR TREATING DISEASES CAUSED BY HELICOBACTER JANSSEN PHARMACEUTICA N.V. (BE) 1995-12-06 EP disclosed
WO-1994018978-A1 SUBSTITUTED AZOLONE DERIVATIVES FOR TREATING DISEASES CAUSED BY HELICOBACTER JANSSEN PHARMACEUTICA N.V. (BE) 1994-09-01 WO disclosed