SCHEMBL23967636

SCHEMBL23967636

Cc1ccc(Cc2cc3cc(-c4ccc(-c5ncco5)cc4)c(Cl)cc3[nH]2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 4/20 0.40
KDM5A P29375 4/20 0.40
KDM5B Q9UGL1 4/20 0.40
P2RX7 Q99572 7/20 0.35
IMPDH2 P12268 1/20 0.33
RHEB Q15382 2/20 0.33
CHEK2 O96017 1/20 0.32
PRKAG1 P54619 2/20 0.31
PRKAA2 P54646 2/20 0.31
PRKAB1 Q9Y478 2/20 0.31
PRKAB2 O43741 1/20 0.31
PRKAA1 Q13131 1/20 0.31
TFDP2 Q14188 1/20 0.31
PRKAG3 Q9UGI9 1/20 0.31
PRKAG2 Q9UGJ0 1/20 0.31
KDM4C Q9H3R0 1/20 0.30
GUSB P08236 1/20 0.30

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
SCHEMBL16069452 0.89 KDM4A (0.46) KDM4AKDM5AKDM5BPRKAG1PRKAA2
SCHEMBL17402604 0.83 HAVCR2 (0.39) KDM4AKDM5AKDM5BIMPDH2RHEB
SCHEMBL23967852 0.79 PRKAG1 (0.45) KDM4AKDM5AKDM5BRHEBCHEK2
SCHEMBL17402602 0.77 PTGS2 (0.41)
SCHEMBL17402603 0.76 PRKAG1 (0.40) RHEBPRKAG1PRKAA2PRKAB1PRKAB2
SCHEMBL17402637 0.75 PRKAB2 (0.45) KDM4AKDM5AKDM5BRHEBCHEK2
SCHEMBL16069459 0.74 PRKAG1 (0.47) KDM4AKDM5AKDM5BPRKAG1PRKAA2
SCHEMBL16069896 0.73 PRKAG1 (0.43) KDM4AKDM5AKDM5BPRKAG1PRKAA2
SCHEMBL17391579 0.73 MAPK14 (0.43) KDM4AKDM5AKDM5BPRKAG1PRKAA2
SCHEMBL16069464 0.72 PRKAG1 (0.54) KDM4AKDM5AKDM5BPRKAG1PRKAA2

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-2970119-B1 NOVEL INDOLE DERIVATIVES USEFUL AS ANTI-DIABETIC AGENTS MERCK SHARP & DOHME (US) 2021-11-03 EP disclosed