SCHEMBL2909504

SCHEMBL2909504

COc1ccc(-c2ncccc2CNC2CCCCC2)nc1O[C@@H]1CCOC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.41
MTOR P42345 4/20 0.40
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PDCD1 Q15116 2/20 0.38
CD274 Q9NZQ7 2/20 0.38
PDE1B Q01064 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL2902816 0.86 PDCD1 (0.41) SYKMTORPDCD1CD274
SCHEMBL2909862 0.84 GSK3B (0.38) SYKMEN1KMT2AGAAALDH1A1
SCHEMBL2910850 0.84 MAPT (0.39) SYKGAAALDH1A1
SCHEMBL2910038 0.77 SYK (0.39) SYK
SCHEMBL2901839 0.69 VCP (0.43) KDM4EALDH1A1
SCHEMBL2901841 0.69 VCP (0.43) KDM4EALDH1A1
SCHEMBL2906226 0.69 CCNT1 (0.41) SYK
SCHEMBL29672021 0.68 KDM1A (0.53) PDCD1CD274PDE1B
SCHEMBL2909451 0.68 SYK (0.38) SYKMEN1KMT2AKDM4ETDP1
SCHEMBL2903176 0.66 PDE4D (0.44) PDE4APDE4BPDE4CPDE4D

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-1692109-B1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARM CORP (US) 2010-08-18 EP claimed