SCHEMBL30366002

SCHEMBL30366002

CN(c1cncc(S(N)(=O)=O)c1)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.45
CA2 P00918 3/20 0.35
S1PR1 P21453 2/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CYP11B1 P15538 8/20 0.35
CYP11B2 P19099 8/20 0.35
DPP4 P27487 1/20 0.32
DPP9 Q86TI2 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CG P48736 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
CA9 Q16790 1/20 0.31
JAK2 O60674 2/20 0.31
JAK3 P52333 2/20 0.31

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
SCHEMBL27991133 1.00 APLNR (0.45) APLNRCA2S1PR1CA12CA1
SCHEMBL30365746 0.95 APLNR (0.44) APLNRCA2S1PR1CA12CA1
SCHEMBL29284931 0.95 APLNR (0.44) APLNRCA2S1PR1CA12CA1
SCHEMBL27895776 0.75 CA2 (0.58) CA2CA12CA1MEN1NPC1
SCHEMBL15067936 0.73 ALDH1A1 (0.36) APLNRCA2S1PR1CA12CA1
SCHEMBL11690551 0.71 APLNR (0.71) APLNRCA2CA12CA1PIK3CD
SCHEMBL1238865 0.71 CA2 (0.47) CA2S1PR1CA12CA1MEN1
SCHEMBL23501716 0.70 ALDH1A1 (0.65) CYP11B1CYP11B2MEN1NPC1POLB
SCHEMBL29934024 0.70 ALDH1A1 (0.65) CYP11B1CYP11B2MEN1NPC1POLB
SCHEMBL1238821 0.69 CA2 (0.55) CA2S1PR1CA12CA1MEN1

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
EP-4408843-A1 NOVEL SUBSTITUTED SULFONYLUREA COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY Viva Star Biosciences (Suzhou) Co., Ltd. (CN) 2024-08-07 EP disclosed
CN-118251393-A Novel substituted sulfonylurea compounds as inhibitors of interleukin-1 activity 唯久生物技术(苏州)有限公司 2024-06-25 CN disclosed
WO-2023056264-A1 NOVEL SUBSTITUTED SULFONYLUREA COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2023-04-06 WO disclosed