SCHEMBL5808902

SCHEMBL5808902

c1coc(C[AsH]c2ncnc3[nH]cnc23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.42
TSHR P16473 4/20 0.42
HIF1A Q16665 2/20 0.42
CYP1A2 P05177 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
ALOX15 P16050 1/20 0.42
KDR P35968 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4A O75164 1/20 0.39
KDM4B O94953 1/20 0.39
KDM5C P41229 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
POLB P06746 2/20 0.37
HSD17B10 Q99714 2/20 0.36
MGMT P16455 1/20 0.34
CCNB2 O95067 2/20 0.34
CDK1 P06493 2/20 0.34
CCNB1 P14635 2/20 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
SCHEMBL5808903 0.78 SMN1; SMN2 (0.57) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
SCHEMBL1081382 0.77 LMNA (0.38) TSHRCYP1A2MEN1TP53KMT2A
SCHEMBL15950909 0.75 SMN1; SMN2 (0.44) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
Kinetin SCHEMBL29829493 0.74 SMN1; SMN2 (0.66) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
Kinetin SCHEMBL15705 0.74 SMN1; SMN2 (0.66) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
SCHEMBL17009436 0.74 GAA (0.43) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
SCHEMBL19958904 0.73 SMN1; SMN2 (0.42) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
SCHEMBL19064637 0.73 SMN1; SMN2 (0.51) SMN1; SMN2TSHRHIF1ACYP1A2MEN1
SCHEMBL15950879 0.71 MAPT (0.51) TSHRHIF1ACYP1A2MEN1TP53
SCHEMBL17009422 0.71 SMN1; SMN2 (0.49) SMN1; SMN2TSHRHIF1ACYP1A2MEN1

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-2006061627-A2 ANTIAGING COMPOSITION OXONICA LTD (GB) 2006-06-15 WO disclosed