SCHEMBL10531238

SCHEMBL10531238

C#CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOC)c3csc(NC=O)n3)[C@@H]2SC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.58
▸ HTR2C P28335 1/20 0.58
▸ MAPT P10636 3/20 0.56
▸ PPARG P37231 2/20 0.56
▸ SLC22A6 Q4U2R8 2/20 0.56
▸ SLC22A8 Q8TCC7 2/20 0.56
▸ SLC22A11 Q9NSA0 2/20 0.56
▸ ALB P02768 1/20 0.56
▸ PGR P06401 3/20 0.52
▸ PTGS2 P35354 1/20 0.52
▸ KMT2A Q03164 1/20 0.49
▸ DAO P14920 1/20 0.49
▸ SNCA P37840 1/20 0.49
▸ CYP2J2 P51589 1/20 0.49
▸ TDP1 Q9NUW8 5/20 0.49
▸ APEX1 P27695 3/20 0.49
▸ ABCC4 O15439 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ APAF1 O14727 2/20 0.49

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
SCHEMBL10531222 1.00 NR1I2 (0.58) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL9703542 0.91 TDP1 (0.48) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL9703544 0.91 TDP1 (0.48) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10419108 0.88 NR1I2 (0.60) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10419109 0.88 NR1I2 (0.60) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10528758 0.88 NR1I2 (0.75) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL10528776 0.88 NR1I2 (0.75) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL11135071 0.87 NR1I2 (0.67) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL9482626 0.87 TDP1 (0.65) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL9482641 0.87 TDP1 (0.65) 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-0109683-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-10-11 — — EP disclosed
US-4609730-A CEPHALOSPORIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-09-02 — — US disclosed
EP-0109683-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-05-30 — — EP disclosed
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