SCHEMBL30489397

SCHEMBL30489397

COCCCc1cnc(C(N)=O)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.51
TSHR P16473 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
MC4R P32245 1/20 0.37
ADRA1A P35348 1/20 0.37
MC3R P41968 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
TLR7 Q9NYK1 1/20 0.35
IGF1R P08069 1/20 0.34
FGFR1 P11362 1/20 0.34
KDR P35968 1/20 0.34
NNMT P40261 2/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
HCAR3 P49019 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL30112008 0.90 HCAR2 (0.42) SIRT6TSHRHCAR2KDM4EALDH1A1
SCHEMBL19555767 0.90 HCAR2 (0.42) SIRT6TSHRHCAR2KDM4EALDH1A1
SCHEMBL25804805 0.80 KDM4E (0.43) KDM4EALDH1A1L3MBTL1MAPTKMT2A
SCHEMBL29684052 0.78 SIRT6 (0.50) SIRT6TSHRADORA3MC4RADRA1A
SCHEMBL19645365 0.75 SIRT6 (0.67) SIRT6TSHRADORA3MC4RADRA1A
SCHEMBL5047018 0.75 SIRT6 (0.47) SIRT6TSHRADORA3MC4RADRA1A
SCHEMBL27730675 0.74 SIRT6 (0.51) SIRT6KDM4EALDH1A1L3MBTL1MAPT
SCHEMBL2793061 0.74 SIRT6 (0.47) SIRT6ADRA1AHCAR3
SCHEMBL2635320 0.72 SIRT6 (0.73) SIRT6TSHRADORA3MC4RADRA1A
SCHEMBL4697005 0.71 SIRT6 (0.55) SIRT6TSHRADORA3MC4RADRA1A

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
EP-3452456-B1 BICYCLIC MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2023-07-05 EP disclosed