SCHEMBL8108980

SCHEMBL8108980

Cc1cc(Sc2ccccc2)c(N)c(=O)n1CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.45
AKR1B1 P15121 4/20 0.45
ADORA2A P29274 1/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 2/20 0.39
APEX1 P27695 1/20 0.39
SLC6A9 P48067 1/20 0.39
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SIRT1 Q96EB6 1/20 0.37
F2 P00734 1/20 0.37
PRSS1 P07477 1/20 0.37

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
SCHEMBL7773564 0.88 KDM4E (0.47) ADORA2AKDM4ELMNAHPGDALDH1A1
SCHEMBL7377097 0.75 KDM4E (0.44) PTGDR2KDM4ELMNAAPEX1ALDH1A1
SCHEMBL8118964 0.74 PTGDR2 (0.41) PTGDR2KDM4ELMNAAPEX1HPGD
SCHEMBL7376688 0.74 F2 (0.42) KDM4ELMNAAPEX1ALDH1A1F2
SCHEMBL7773815 0.73 F2 (0.62) PTGDR2LMNAALDH1A1F2PRSS1
SCHEMBL7772069 0.71 KDM4E (0.45) KDM4ELMNAHPGDALDH1A1
SCHEMBL11503765 0.68 LMNA (0.50) KDM4ELMNAAPEX1HPGD
SCHEMBL8124061 0.68 FPR1 (0.41) KDM4ELMNACYP2C9CYP2C19ALDH1A1
SCHEMBL4456432 0.67 APEX1 (0.42) KDM4ELMNAAPEX1ALDH1A1F2
Propane SCHEMBL8174578 0.67 POLB (0.41) KDM4ELMNACYP2C9HPGDCYP2C19

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
EP-1019376-A1 PYRIDONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS SYNTHESIS INTERMEDIATES SANOFI-SYNTHELABO (FR) 2000-07-19 EP disclosed
WO-1998031671-A1 PYRIDONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS SYNTHESIS INTERMEDIATES SANOFI-SYNTHELABO (FR) 1998-07-23 WO disclosed