SCHEMBL21604533

SCHEMBL21604533

Cc1nc2nc(Br)c(F)cc2n1C

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 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
SCHEMBL31149381 0.79 ATAD2 (0.38) KDM4EALDH1A1LMNAMAPT
SCHEMBL19267556 0.76 KDM4E (0.45) KDM4EALDH1A1LMNAHTTMAPT
SCHEMBL21604703 0.73 KDM4E (0.33) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL16806047 0.71 KDM4E (0.51) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL10642137 0.69 ALOX15 (0.59) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL20874722 0.69 HSD17B10 (0.47) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL31587437 0.68 KDM4E (0.39) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL21539307 0.68 ACACB (0.39) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL24463268 0.64 KDM4E (0.51) KDM4EALDH1A1LMNAALOX15HTT
SCHEMBL31753089 0.64 HTT (0.34) ALOX15HTT

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-2019243528-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 WO disclosed