SCHEMBL29066909

SCHEMBL29066909

O=S(=O)(O)c1nc(O)c2nccnc2n1.Oc1nc(O)c2nccnc2n1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
COMT P21964 1/20 0.30
ADORA2A P29274 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
SCHEMBL687390 0.93 KDM4E (0.36) KDM4EALOX12CYP1A2CYP2C19HSD17B10
SCHEMBL321932 0.82 ADORA2A (0.40) COMTADORA2A
SCHEMBL9581658 0.64 ADORA2A (0.63) ADORA2A
SCHEMBL687166 0.64 ADORA2A (0.38) ADORA2A
SCHEMBL28161048 0.63 CYP1A2 (0.32) CYP1A2CYP2C19HSD17B10
SCHEMBL686727 0.60 PDE4A (0.38) ADORA2A
SCHEMBL3634528 0.60 CA5A (0.36) CYP1A2CYP2C19HSD17B10
SCHEMBL15461719 0.59 PIK3CG (0.32)
SCHEMBL27372062 0.58 KDM4E (0.42) KDM4EALOX12CYP1A2HSD17B10COMT
SCHEMBL22548858 0.57 ADORA2A (0.35) ADORA2A

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
CN-109557764-B Chemically amplified positive photosensitive resin composition, resist pattern, method for forming the same, and electronic device 奇美实业股份有限公司 2023-09-12 CN disclosed