SCHEMBL29459263

SCHEMBL29459263

CCS(=O)(=O)c1nc2c3c(ccc2s1)OCO3

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ AOC3 Q16853 3/20 0.33
▸ RXFP1 Q9HBX9 4/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ HSD17B10 Q99714 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ PTGS2 P35354 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ RGS12 O14924 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ ALOX12 P18054 1/20 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
SCHEMBL23706905 1.00 LMNA (0.35) LMNAGAAKMT2AMAPTAOC3
SCHEMBL26132956 0.89 LMNA (0.36) LMNAKMT2AMAPTRXFP1DRD2
SCHEMBL26464006 0.83 PIK3CB (0.32) LMNAMAPTAOC3HSD17B10ALDH1A1
SCHEMBL23706873 0.83 PIK3CB (0.32) LMNAMAPTAOC3HSD17B10ALDH1A1
SCHEMBL29459325 0.74 ALDH1A1 (0.40) LMNAKMT2AMAPTAOC3DRD2
SCHEMBL23706910 0.74 ALDH1A1 (0.40) LMNAKMT2AMAPTAOC3DRD2
SCHEMBL18189623 0.73 RORC (0.51) POLB
SCHEMBL23706872 0.72 NPC1 (0.33) LMNAKMT2AMAPTAOC3HSD17B10
SCHEMBL26462916 0.71 NPC1 (0.36) LMNAMAPTHSD17B10ALDH1A1RAB9A
SCHEMBL29459319 0.69 CA2 (0.38) LMNAKMT2AMAPTRXFP1HSD17B10

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-2022059778-A1 CYCLIC UREA DERIVATIVE カルナバイオサイエンス株式会社 2022-03-24 — — WO disclosed
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