SCHEMBL19456917

SCHEMBL19456917

COC(=O)C(C)(C)Sc1ccc(C#N)n2c(Br)cnc12

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PLCG1 P19174 1/20 0.36
▸ SLC22A12 Q96S37 7/20 0.33

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
SCHEMBL19456916 0.87 SLC22A12 (0.42) SLC22A12
SCHEMBL19456915 0.84 SLC22A12 (0.31) SLC22A12
SCHEMBL19456817 0.77 SLC22A12 (0.43) PLCG1SLC22A12
SCHEMBL19456713 0.70 SLC22A12 (0.33) SLC22A12
SCHEMBL19456912 0.66 SLC22A12 (0.53) PLCG1SLC22A12
SCHEMBL19456820 0.66 SLC22A12 (0.53) PLCG1SLC22A12
SCHEMBL19456710 0.65 SSTR4 (0.42) PLCG1SLC22A12
SCHEMBL15159024 0.64 SLC22A12 (0.48) SLC22A12
SCHEMBL19456731 0.64 RIPK2 (0.36) —
SCHEMBL19456819 0.64 SLC22A12 (0.56) SLC22A12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107683282-B URAT1 inhibitor and application thereof in medicine 江苏新元素医药科技有限公司 2020-05-22 — — CN disclosed
WO-2017173965-A1 NOVEL URAT1 INHIBITOR AND PHARMACEUTICAL APPLICATION THEREOF 江苏新元素医药科技有限公司 2017-10-12 — — WO disclosed
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