SCHEMBL20514738

SCHEMBL20514738

O=Cc1c(O)c(-c2c(O)c(C=O)c3nc4c(O)ccc(C(=O)O)c4nc3c2O)c(O)c2nc3c(C(=O)O)ccc(O)c3nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.40
SELL P14151 1/20 0.40
SELP P16109 1/20 0.40
KDM4A O75164 3/20 0.38
KDM4E B2RXH2 1/20 0.38
KDM6B O15054 1/20 0.38
KDM6A O15550 1/20 0.38
TET3 O43151 1/20 0.38
KDM4B O94953 1/20 0.38
KDM5C P41229 1/20 0.38
KDM4D Q6B0I6 1/20 0.38
TET2 Q6N021 1/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
TET1 Q8NFU7 1/20 0.38
FTO Q9C0B1 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM3A Q9Y4C1 1/20 0.38

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
SCHEMBL10343978 0.86 ERN1 (0.38) ERN1SELLSELPKDM4AKDM4E
SCHEMBL10074399 0.85 KDM4E (0.42) ERN1KDM4ELMNACYP3A4MAPT
SCHEMBL10343989 0.82 ERN1 (0.40) ERN1SELLSELPKDM4AKDM4E
SCHEMBL16431381 0.80 SELL (0.52) SELLSELPKDM4AKDM4EKDM6B
SCHEMBL20514733 0.78 SELL (0.39) SELLSELPKDM4AKDM4EKDM6B
SCHEMBL10678485 0.75 ERN1 (0.41) ERN1KDM4EL3MBTL1LMNACYP3A4
SCHEMBL10075148 0.75 SELL (0.41) SELLSELPKDM4AKDM4EKDM6B
SCHEMBL10675349 0.73 SELL (0.37) SELLSELPKDM4AKDM4EKDM6B
SCHEMBL10673114 0.73 GSK3B (0.32) ERN1
SCHEMBL10669274 0.72 PIM1 (0.39) SELLSELPKDM4AKDM4EKDM6B

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-2655334-B1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS PHARMACEUTICALS INC (US) 2018-10-03 EP claimed
EP-2655334-B1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS PHARMACEUTICALS INC (US) 2018-10-03 EP disclosed