SCHEMBL10833256

SCHEMBL10833256

Nc1nc(/C(=N/OCC(=O)O)C(=O)N[C@@H]2C(=O)N3C(C(=O)O)=C(CSc4nnnn4N)CS[C@@H]23)cs1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 4/20 0.75
▸ PGR P06401 2/20 0.75
▸ TDP1 Q9NUW8 7/20 0.66
▸ APEX1 P27695 3/20 0.66
▸ APAF1 O14727 2/20 0.66
▸ L3MBTL1 Q9Y468 2/20 0.66
▸ LMNA P02545 2/20 0.66
▸ TSHR P16473 1/20 0.66
▸ PLCG1 P19174 1/20 0.66
▸ ABCC2 Q92887 1/20 0.66
▸ SIRT5 Q9NXA8 1/20 0.66
▸ PSMD14 O00487 1/20 0.65
▸ MMP2 P08253 1/20 0.65
▸ PPARG P37231 2/20 0.64
▸ SLC22A6 Q4U2R8 2/20 0.64
▸ SLC22A8 Q8TCC7 2/20 0.64
▸ SLC22A11 Q9NSA0 2/20 0.64
▸ DAO P14920 1/20 0.64
▸ SNCA P37840 1/20 0.64
▸ CYP2J2 P51589 1/20 0.64

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
SCHEMBL10833878 0.95 NR1I2 (0.74) NR1I2PGRTDP1APEX1APAF1
SCHEMBL10832861 0.94 NR1I2 (0.77) NR1I2PGRTDP1APEX1APAF1
SCHEMBL10832903 0.94 NR1I2 (0.74) NR1I2PGRTDP1APEX1APAF1
SCHEMBL10833269 0.93 NR1I2 (0.74) NR1I2PGRTDP1APEX1APAF1
SCHEMBL11004971 0.93 NR1I2 (0.88) NR1I2PGRTDP1APEX1APAF1
SCHEMBL11004976 0.93 NR1I2 (0.88) NR1I2PGRTDP1APEX1APAF1
SCHEMBL10832404 0.93 NR1I2 (0.87) NR1I2PGRTDP1APEX1L3MBTL1
SCHEMBL11145121 0.93 NR1I2 (0.87) NR1I2PGRTDP1APEX1L3MBTL1
SCHEMBL11145116 0.93 NR1I2 (0.87) NR1I2PGRTDP1APEX1L3MBTL1
SCHEMBL10831933 0.92 NR1I2 (0.73) NR1I2PGRTDP1APEX1APAF1

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
US-4576938-A Cephalosporin compound and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1986-03-18 — — US disclosed
EP-0081971-A2 Novel cephalosporin compound and process for preparing the same Tanabe Seiyaku Co., Ltd. (JP) 1983-06-22 — — EP disclosed
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