SCHEMBL10984589

SCHEMBL10984589

O=CNc1nc(C(=NOC2C=CCC2)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4ccc5nnnn5n4)CS[C@@H]23)cs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 5/20 0.51
▸ PGR P06401 3/20 0.51
▸ SLC22A6 Q4U2R8 4/20 0.44
▸ SLC22A8 Q8TCC7 4/20 0.44
▸ SLC22A11 Q9NSA0 4/20 0.44
▸ PPARG P37231 3/20 0.44
▸ DAO P14920 1/20 0.44
▸ SNCA P37840 1/20 0.44
▸ CYP2J2 P51589 1/20 0.44
▸ ABCC4 O15439 1/20 0.44
▸ HTR2C P28335 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 4/20 0.42
▸ ALB P02768 1/20 0.42
▸ TDP1 Q9NUW8 4/20 0.40
▸ APEX1 P27695 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL10984587 1.00 NR1I2 (0.51) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL9705437 0.92 NR1I2 (0.54) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10565900 0.92 NR1I2 (0.54) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL9705440 0.92 NR1I2 (0.54) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10981739 0.92 NR1I2 (0.62) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10981736 0.92 NR1I2 (0.62) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10990662 0.89 NR1I2 (0.66) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10990661 0.89 NR1I2 (0.66) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10988026 0.88 NR1I2 (0.56) NR1I2PGRSLC22A6SLC22A8SLC22A11
SCHEMBL10988027 0.88 NR1I2 (0.56) NR1I2PGRSLC22A6SLC22A8SLC22A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4529802-A A carboxylated thiazole oxime compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-07-16 — — US disclosed
EP-0025199-B1 CEPHEM COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-31 — — EP disclosed
US-4394384-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-07-19 — — US disclosed
EP-0025199-A2 Cephem compounds, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-03-18 — — EP disclosed
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