SCHEMBL18708229

SCHEMBL18708229

CN(C)CCCCNCc1cc(C(O)O)ccn1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 11/20 0.40
▸ KDM5C P41229 8/20 0.40
▸ KDM5A P29375 7/20 0.40
▸ KDM4A O75164 2/20 0.40
▸ KDM6B O15054 1/20 0.40
▸ KDM2B Q8NHM5 1/20 0.40
▸ CHRM2 P08172 1/20 0.39
▸ SIRT2 Q8IXJ6 3/20 0.39
▸ KDM4C Q9H3R0 2/20 0.39
▸ KDM5D Q9BY66 1/20 0.39
▸ TERT O14746 2/20 0.39
▸ ALOX15 P16050 1/20 0.36
▸ FERMT2 Q96AC1 1/20 0.36
▸ CCNA2 P20248 1/20 0.34
▸ CDK2 P24941 1/20 0.34

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
SCHEMBL18699881 0.80 KDM5B (0.37) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16292979 0.78 CHRM2 (0.41) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16291684 0.78 KDM5B (0.64) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16305488 0.77 CHRM2 (0.43) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16292333 0.77 KDM5B (0.40) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15994303 0.77 TERT (0.38) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16293382 0.76 CHRM2 (0.42) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16293260 0.75 CHRM2 (0.71) CHRM2SIRT2TERTALOX15
SCHEMBL16305525 0.74 TERT (0.44) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16291904 0.74 KDM5B (0.65) KDM5BKDM5CKDM5AKDM4AKDM6B

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-3150582-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. (US) 2017-04-05 — — EP disclosed
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