SCHEMBL11038802

SCHEMBL11038802

Cc1c(-c2ccccc2)oc2c(C(=O)O[C@H]3CCCC[C@@H]3N3CCCCC3)cccc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.62
HTR1A P08908 3/20 0.62
ADRA1A P35348 3/20 0.62
KDM4E B2RXH2 2/20 0.62
CYP1A2 P05177 1/20 0.62
CHRM2 P08172 1/20 0.62
CYP3A4 P08684 1/20 0.62
ADRA2A P08913 1/20 0.62
ADORA3 P0DMS8 1/20 0.62
CYP2D6 P10635 1/20 0.62
CHRM1 P11229 1/20 0.62
ACHE P22303 1/20 0.62
SLC6A2 P23975 1/20 0.62
PDE4A P27815 1/20 0.62
OPRM1 P35372 1/20 0.62
DRD3 P35462 1/20 0.62
KCNH2 Q12809 1/20 0.62
HRH3 Q9Y5N1 1/20 0.62
ALDH1A1 P00352 6/20 0.51
SMN1; SMN2 Q16637 4/20 0.51

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
SCHEMBL10959904 1.00 LMNA (0.62) LMNAHTR1AADRA1AKDM4ECYP1A2
SCHEMBL10957900 1.00 LMNA (0.62) LMNAHTR1AADRA1AKDM4ECYP1A2
SCHEMBL10961357 1.00 LMNA (0.62) LMNAHTR1AADRA1AKDM4ECYP1A2
SCHEMBL10959899 1.00 LMNA (0.62) LMNAHTR1AADRA1AKDM4ECYP1A2
Hydrochloric Acid SCHEMBL10957861 0.99 LMNA (0.61) LMNAHTR1AADRA1AKDM4ECYP1A2
Hydrochloric Acid SCHEMBL10957863 0.99 LMNA (0.61) LMNAHTR1AADRA1AKDM4ECYP1A2
Hydrochloric Acid SCHEMBL10957866 0.99 LMNA (0.61) LMNAHTR1AADRA1AKDM4ECYP1A2
SCHEMBL10958937 0.86 LMNA (0.66) LMNAHTR1AADRA1AKDM4ECYP1A2
SCHEMBL10956045 0.82 LMNA (0.58) LMNAHTR1AADRA1AKDM4ECYP1A2
Hydrochloric Acid SCHEMBL10957802 0.81 LMNA (0.57) LMNAHTR1AADRA1AKDM4ECYP1A2

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-0072620-B1 3-METHYLFLAVONE-8-CARBOXYLIC ACID ESTERS RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1985-12-04 EP claimed
EP-0072620-A1 3-Methylflavone-8-carboxylic acid esters RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1983-02-23 EP claimed