SCHEMBL10353768

SCHEMBL10353768

CO/N=C(/C(=O)NC1C(=O)N2C(C(=O)O)=C(/C=C/c3cncs3)CS[C@H]12)c1csc(N)n1.[NaH]

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 5/20 0.67
▸ HTR2C P28335 1/20 0.67
▸ MAPT P10636 5/20 0.65
▸ PPARG P37231 2/20 0.65
▸ SLC22A6 Q4U2R8 2/20 0.65
▸ SLC22A8 Q8TCC7 2/20 0.65
▸ SLC22A11 Q9NSA0 2/20 0.65
▸ ALB P02768 1/20 0.65
▸ TDP1 Q9NUW8 6/20 0.63
▸ APEX1 P27695 3/20 0.63
▸ APAF1 O14727 2/20 0.63
▸ LMNA P02545 2/20 0.63
▸ L3MBTL1 Q9Y468 2/20 0.63
▸ TSHR P16473 1/20 0.63
▸ PLCG1 P19174 1/20 0.63
▸ ABCC2 Q92887 1/20 0.63
▸ SIRT5 Q9NXA8 1/20 0.63
▸ PGR P06401 3/20 0.63
▸ PTGS2 P35354 1/20 0.63
▸ PSMD14 O00487 1/20 0.63

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
SCHEMBL10354003 0.99 NR1I2 (0.68) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10354004 0.99 NR1I2 (0.68) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10353771 0.92 TDP1 (0.66) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL7767597 0.91 TDP1 (0.75) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL7764651 0.90 TDP1 (0.76) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL7763067 0.90 TDP1 (0.76) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10896057 0.90 NR1I2 (0.73) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10892691 0.90 NR1I2 (0.73) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10892719 0.90 NR1I2 (0.73) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10354013 0.89 NR1I2 (0.60) NR1I2HTR2CMAPTPPARGSLC22A6

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-0175610-B1 NEW CEPHALOSPORIN COMPOUNDS AND THE PRODUCTION THEREOF MEIJI SEIKA KAISHA LTD. (JP) 1990-08-29 — — EP disclosed
US-4839350-A Cephalosporin compounds and the production thereof MEIJI SEIKA KAISHA, LTD. (JP) 1989-06-13 — — US disclosed
EP-0175610-A2 New cephalosporin compounds and the production thereof MEIJI SEIKA KAISHA LTD. (JP) 1986-03-26 — — EP disclosed
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