SCHEMBL2910038

SCHEMBL2910038

COc1ccc(-c2ncccc2CNc2ccc(-c3nn[nH]n3)cc2)nc1O[C@@H]1CCOC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 7/20 0.39
GRM4 Q14833 7/20 0.36
NTRK1 P04629 1/20 0.35
XDH P47989 1/20 0.35
AURKA O14965 2/20 0.34
ACLY P53396 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
SCHEMBL2909504 0.77 SYK (0.41) SYK
SCHEMBL2908116 0.73 AURKA (0.36) SYKGRM4XDHAURKAACLY
SCHEMBL2902373 0.73 AURKA (0.36) SYKGRM4XDHAURKAACLY
SCHEMBL2908119 0.72 XDH (0.36) SYKXDHAURKA
SCHEMBL2902816 0.70 PDCD1 (0.41) SYK
SCHEMBL2909862 0.70 GSK3B (0.38) SYK
SCHEMBL2909451 0.68 SYK (0.38) SYKGRM4NTRK1
SCHEMBL2910850 0.68 MAPT (0.39) SYK
SCHEMBL2906226 0.66 CCNT1 (0.41) SYKGRM4
SCHEMBL14032823 0.65 ALDH1A1 (0.47)

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