SCHEMBL1667703

SCHEMBL1667703

Cc1ccc(C)n1-c1c(C#N)c2cccnc2n1-c1ccc(O)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.41
KDM4E B2RXH2 1/20 0.39
KDM4D Q6B0I6 2/20 0.37
ELANE P08246 7/20 0.36
PIK3CG P48736 1/20 0.35
FEN1 P39748 1/20 0.34
PTPN1 P18031 1/20 0.34
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.32

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
SCHEMBL1667847 0.83 USP14 (0.46) USP14KDM4EELANEFEN1
SCHEMBL1667710 0.81 USP14 (0.39) USP14KDM4EKDM4DELANE
SCHEMBL1667713 0.81 USP14 (0.39) USP14KDM4EKDM4DELANE
SCHEMBL1667576 0.80 KDM4E (0.41) USP14KDM4EKDM4DELANEFEN1
SCHEMBL1667769 0.78 ELANE (0.39) USP14KDM4EKDM4DELANEPIK3CG
SCHEMBL12797301 0.77 HSP90AA1 (0.41) USP14KDM4EFEN1ALDH1A1TSHR
SCHEMBL1667598 0.77 ELANE (0.38) USP14KDM4EKDM4DELANEPIK3CG
SCHEMBL1667597 0.77 ELANE (0.38) USP14KDM4EKDM4DELANEPIK3CG
SCHEMBL1667600 0.77 ELANE (0.38) USP14KDM4EKDM4DELANEPIK3CG
SCHEMBL1667776 0.76 NTRK1 (0.37) USP14KDM4EFEN1ALDH1A1TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011042474-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO claimed
WO-2011042474-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO disclosed
WO-2011042474-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO disclosed