SCHEMBL10852201

SCHEMBL10852201

CC(C)(C)OC(=O)C(ON1C(=O)c2ccccc2C1=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
TNF P01375 1/20 0.38
RECQL P46063 1/20 0.37
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL2292893 0.84 TNF (0.50) TNFKMT2AMEN1
SCHEMBL17425006 0.81 ALDH1A1 (0.41) CYP3A4CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL17093931 0.81 LMNA (0.39) ALDH1A1CYP1A2CYP2C9TNFLMNA
SCHEMBL10851634 0.81 LMNA (0.39) ALDH1A1CYP1A2CYP2C9TNFLMNA
SCHEMBL29850460 0.81 LMNA (0.39) ALDH1A1CYP1A2CYP2C9TNFLMNA
SCHEMBL13764941 0.81 LMNA (0.39) ALDH1A1CYP1A2CYP2C9TNFLMNA
SCHEMBL10854521 0.79 PTPRC (0.37) ALDH1A1CYP1A2CYP2C9POLBLMNA
SCHEMBL9559200 0.78 ALDH1A1 (0.44) CYP3A4CYP2C19ALDH1A1CYP1A2CYP2C9
SCHEMBL24307918 0.78 PLA2G1B (0.39) ALDH1A1CYP1A2CYP2C9TNFPOLB
SCHEMBL4218555 0.78 CTRB1 (0.46) CYP3A4CYP2C19ALDH1A1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4567275-A 2-(5-AMINO-1,2,4-THIADIAZOL-3-YL)GLYOXYLIC ACID FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-28 US disclosed
EP-0064582-B1 STARTING COMPOUNDS FOR PREPARING CEPHEM COMPOUNDS AND PROCESSES FOR THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-12-11 EP disclosed
EP-0013762-B1 CEPHEM AND CEPHAM COMPOUNDS, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-03-13 EP disclosed
US-4468515-A CEPRALOSPORINS, MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-08-28 US disclosed
US-4425340-A ANTIBIOTICS, BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-01-10 US disclosed
US-4390534-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-06-28 US disclosed
US-4381299-A 7-Amino-thiadiazole oxyimino derivatives of cephem and cepham compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-26 US disclosed
EP-0064582-A1 Starting compounds for preparing cephem compounds and processes for their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-11-17 EP disclosed
US-4332798-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-06-01 US disclosed
US-4331665-A ANTIBIOTICS, BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-05-25 US disclosed
EP-0013762-A2 Cephem and cepham compounds, processes for their preparation, pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-08-06 EP disclosed
US-4144393-A 3-Acetoxymethyl cephalosporins having at position-7 a carboxy substituted α-etherified hydroxyiminoarylacetamido group GLAXO LABORATORIES LIMITED (GB) 1979-03-13 US disclosed
US-4103084-A ANTIBIOTICS GLAXO LABORATORIES LIMITED (GB) 1978-07-25 US disclosed