SCHEMBL20135458

SCHEMBL20135458

O=C(O)N1CCC(n2cc3ccccc3n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 2/20 0.53
LMNA P02545 2/20 0.40
KDM6B O15054 1/20 0.39
KDM4A O75164 1/20 0.39
KDM5C P41229 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
L3MBTL3 Q96JM7 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HIF1A Q16665 1/20 0.38
BTK Q06187 2/20 0.38
FAAH O00519 1/20 0.38
HTR2B P41595 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36

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
SCHEMBL26684084 0.81 KDM5A (0.40) KDM5AL3MBTL3L3MBTL1ALDH1A1KDM4E
SCHEMBL26684343 0.81 KDM4E (0.42) KDM5AKDM6BKDM4AKDM5CKDM4C
SCHEMBL17404485 0.81 KDM5A (0.43) KDM5AALDH1A1KDM4E
SCHEMBL20135591 0.81 GPR119 (0.50) KDM5AKDM4E
SCHEMBL29303031 0.78 KDM5A (0.41) KDM5AALDH1A1KDM4EMEN1KMT2A
SCHEMBL30344501 0.77 KDM5A (0.40) KDM5ALMNAKDM6BFAAHHDAC8
SCHEMBL28549617 0.77 HRH3 (0.42) KDM5ALMNAALDH1A1KDM4EMEN1
SCHEMBL20809468 0.74 TLR8 (0.52) KDM5AALDH1A1KDM4EMEN1KMT2A
SCHEMBL30177181 0.74 IRAK4 (0.42) KDM5A
SCHEMBL20377779 0.74 IRAK4 (0.35) KDM5A

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-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP disclosed