SCHEMBL8958470

SCHEMBL8958470

COC(OC)c1ccc(-c2ccccc2)c(C2=NC(C)(C)CO2)c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
HRH3 Q9Y5N1 4/20 0.35
LMNA P02545 2/20 0.35
IL2 P60568 1/20 0.35
HTT P42858 2/20 0.34
ATM Q13315 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
CYP2D6 P10635 1/20 0.31
BACE1 P56817 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
SCHEMBL7010105 0.86 KDM4E (0.42) KDM4EHRH3LMNAIL2HTT
SCHEMBL7934334 0.79 KDM4E (0.45) KDM4EHRH3LMNAIL2HTT
SCHEMBL7112634 0.78 KDM4E (0.53) KDM4EHRH3LMNAIL2HTT
SCHEMBL8958596 0.77 HRH3 (0.39) KDM4EHRH3LMNAIL2HTT
SCHEMBL10835648 0.76 KDM4E (0.50) KDM4EHRH3LMNAIL2HTT
SCHEMBL7937331 0.75 FABP4 (0.42) KDM4EHRH3LMNAIL2HTT
SCHEMBL8958463 0.74 HRH3 (0.38) KDM4EHRH3LMNAIL2HTT
SCHEMBL11485826 0.74 KDM4E (0.45) KDM4EHRH3LMNAIL2HTT
SCHEMBL5258630 0.73 KDM4E (0.42) KDM4EHRH3LMNAHTTALDH1A1
SCHEMBL342910 0.72 KDM4E (0.59) KDM4EHRH3LMNAIL2HTT

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
US-5559236-A Intermediates for substituted biphenylmethylmidazopyridine angiotensin II antagonists EISAI CO., LTD. (JP) 1996-09-24 US disclosed