SCHEMBL13680935

SCHEMBL13680935

CNOOSc1ccc(-c2nc(CCC=O)cs2)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 7/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
THRB P10828 1/20 0.35

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
SCHEMBL13680944 0.87 KDM4E (0.41) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680509 0.76 CYP3A4 (0.40) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680926 0.76 LMNA (0.56) LMNARAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13680929 0.75 ALDH1A1 (0.62) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680951 0.74 MAPT (0.55) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680958 0.74 RXFP1 (0.57) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680939 0.74 MAPT (0.47) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680922 0.73 GFER (0.62) LMNARAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL13680943 0.73 RAB9A (0.48) LMNARAB9AKDM4EALDH1A1HPGD
SCHEMBL13680920 0.73 RAB9A (0.56) LMNARAB9AKDM4EALDH1A1HPGD

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-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed