SCHEMBL21716667

SCHEMBL21716667

CCOC(O)c1ccnc(CN(CC(=O)N(CC)CCN(C)C)C(=O)OC(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 14/20 0.39
▸ KDM5C P41229 8/20 0.39
▸ KDM5A P29375 7/20 0.39
▸ KDM4C Q9H3R0 2/20 0.39
▸ KDM4A O75164 2/20 0.39
▸ KDM6B O15054 1/20 0.39
▸ KDM2B Q8NHM5 1/20 0.39
▸ KDM5D Q9BY66 1/20 0.38
▸ SSTR4 P31391 1/20 0.35
▸ ACKR3 P25106 2/20 0.33
▸ TRPM8 Q7Z2W7 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ NLRP3 Q96P20 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
SCHEMBL16296605 0.84 KDM5B (0.44) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15994238 0.83 KDM5B (0.43) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15636647 0.83 KDM5B (0.58) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15994187 0.82 KDM5B (0.43) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15635733 0.81 KDM5B (0.61) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15637432 0.79 KDM5B (0.45) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15637020 0.77 KDM5B (0.45) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15636770 0.77 KDM5B (0.47) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716672 0.77 KDM5B (0.66) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15994354 0.76 KDM5B (0.56) KDM5BKDM5CKDM5AKDM4CKDM4A

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
WO-2020033377-A1 HISTONE DEMETHYLASE 5 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-02-13 — — WO disclosed
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