SCHEMBL6623532

SCHEMBL6623532

N#Cc1cnn2c(=O)c(CCO)c(O)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLAT P00750 3/20 0.42
▸ KDM4E B2RXH2 4/20 0.41
▸ KDM5A P29375 2/20 0.40
▸ KDM4D Q6B0I6 1/20 0.37
▸ UPP1 Q16831 2/20 0.33
▸ POLB P06746 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ CSNK2A2 P19784 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL9204181 0.86 KDM4E (0.45) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL6624656 0.78 KDM4E (0.46) PLATKDM4EKDM5APOLBHTT
SCHEMBL16046861 0.77 KDM5A (0.46) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL16046600 0.76 KDM5A (0.43) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL16048043 0.75 KDM5A (0.50) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL16046669 0.74 KDM5A (0.48) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL18159119 0.73 KDM5A (0.53) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL16046987 0.73 KDM5A (0.56) PLATKDM4EKDM5AKDM4DPOLB
SCHEMBL16047853 0.73 KDM5A (0.37) PLATKDM4EKDM5AKDM4DHSD17B10
SCHEMBL17547884 0.72 KDM5A (0.40) PLATKDM4EKDM5AKDM4DPOLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976754-B1 REMEDIES/PREVENTIVES FOR RESPIRATORY DISEASES POLA CHEM IND INC (JP) 2004-07-14 — — EP disclosed
US-6329382-B1 TREATMENT OF RESPIRATORY DISEASES POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 — — US disclosed
EP-0976754-A1 REMEDIES/PREVENTIVES FOR RESPIRATORY DISEASES POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-02-02 — — EP disclosed
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