SCHEMBL8215310

SCHEMBL8215310

CC(C)(C)OC(=O)N1CC2CC(NCc3cccc(Cl)c3)CC2C1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 2/20 0.47
PRMT6 Q96LA8 2/20 0.47
TP53 P04637 1/20 0.46
NR1H2 P55055 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
STS P08842 2/20 0.45
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
USP30 Q70CQ3 2/20 0.43
KCNK3 O14649 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
ANO1 Q5XXA6 1/20 0.40
GRIN2B Q13224 1/20 0.40
NAMPT P43490 1/20 0.40

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
SCHEMBL21276172 1.00 CARM1 (0.47) CARM1PRMT6TP53NR1H2SMN1; SMN2
SCHEMBL22435955 0.87 JAK1 (0.54) NR1H2STSJAK2JAK1USP30
SCHEMBL10449417 0.87 JAK1 (0.54) NR1H2STSJAK2JAK1USP30
SCHEMBL10320157 0.87 JAK1 (0.54) NR1H2STSJAK2JAK1USP30
SCHEMBL4875893 0.87 JAK1 (0.54) NR1H2STSJAK2JAK1USP30
SCHEMBL4139961 0.85 STS (0.56) CARM1PRMT6TP53SMN1; SMN2STS
SCHEMBL6269523 0.82 JAK2 (0.50) NR1H2STSJAK2JAK1USP30
SCHEMBL21276388 0.81 NR1H2 (0.50) TP53NR1H2SMN1; SMN2JAK2JAK1
SCHEMBL20557045 0.81 NR1H2 (0.47) TP53NR1H2STSJAK2JAK1
SCHEMBL21094341 0.81 NR1H2 (0.47) TP53NR1H2STSJAK2JAK1

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-2008065500-A2 HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2008-06-05 WO disclosed