SCHEMBL10372943

SCHEMBL10372943

CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)C(=NOC3CSC3)c3csc(N)n3)[C@H]2SC1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.82
▸ MAPT P10636 4/20 0.82
▸ PPARG P37231 3/20 0.82
▸ SLC22A6 Q4U2R8 2/20 0.82
▸ SLC22A8 Q8TCC7 2/20 0.82
▸ SLC22A11 Q9NSA0 2/20 0.82
▸ ALB P02768 1/20 0.82
▸ HTR2C P28335 1/20 0.71
▸ TDP1 Q9NUW8 6/20 0.71
▸ APEX1 P27695 3/20 0.71
▸ ABCC4 O15439 3/20 0.71
▸ LMNA P02545 2/20 0.71
▸ L3MBTL1 Q9Y468 2/20 0.71
▸ CYP1A2 P05177 1/20 0.71
▸ PKM P14618 1/20 0.71
▸ HSD17B10 Q99714 1/20 0.71
▸ ALDH1A1 P00352 1/20 0.71
▸ POLB P06746 1/20 0.71
▸ RECQL P46063 1/20 0.71
▸ NPSR1 Q6W5P4 1/20 0.71

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
SCHEMBL9703826 0.94 NR1I2 (0.85) NR1I2MAPTPPARGSLC22A6SLC22A8
SCHEMBL11104776 0.93 NR1I2 (0.82) NR1I2MAPTPPARGSLC22A6SLC22A8
SCHEMBL11108818 0.92 NR1I2 (0.81) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL2220120 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL9395572 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL5441795 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL15410 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL17422140 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL14594281 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8
Cefotaxime SCHEMBL10748430 0.90 NR1I2 (1.00) NR1I2MAPTPPARGSLC22A6SLC22A8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0047491-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-24 — — EP claimed
US-4416879-A CEPHALOSPORINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-22 — — US claimed
EP-0047491-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-03-17 — — EP claimed
EP-0184227-B1 2-OXYMINO 2-AMINOTHIAZOLYL ACETIC ACID DERIVATIVES AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-02-28 — — EP disclosed
EP-0047491-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-24 — — EP disclosed
EP-0184227-A1 2-Oxymino 2-aminothiazolyl acetic acid derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-06-11 — — EP disclosed
US-4533738-A THIAZOLE INTERMEDIATES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-08-06 — — US disclosed
US-4416879-A CEPHALOSPORINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-22 — — US disclosed
EP-0047491-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-03-17 — — EP disclosed
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