SCHEMBL10854402

SCHEMBL10854402

CC(C)(O/N=C(/C(=O)NC1C(=O)N2C(C(=O)O)=C(CSc3nncs3)CS[C@H]12)c1nsc(N)n1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 5/20 0.53
▸ PGR P06401 3/20 0.53
▸ PPARG P37231 3/20 0.52
▸ ESR1 P03372 1/20 0.52
▸ TDP1 Q9NUW8 4/20 0.51
▸ HSD17B10 Q99714 3/20 0.51
▸ SLC22A6 Q4U2R8 2/20 0.50
▸ SLC22A8 Q8TCC7 2/20 0.50
▸ SLC22A11 Q9NSA0 2/20 0.50
▸ DAO P14920 1/20 0.50
▸ SNCA P37840 1/20 0.50
▸ CYP2J2 P51589 1/20 0.50
▸ ABCC4 O15439 1/20 0.49
▸ HTR2C P28335 1/20 0.49
▸ KMT2A Q03164 1/20 0.48
▸ MAPT P10636 4/20 0.48
▸ ALB P02768 1/20 0.48
▸ KCNH2 Q12809 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ POLB P06746 2/20 0.45

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
SCHEMBL10854408 1.00 NR1I2 (0.53) NR1I2PGRPPARGESR1TDP1
SCHEMBL10853791 0.94 NR1I2 (0.49) NR1I2PGRPPARGESR1TDP1
SCHEMBL10853790 0.94 NR1I2 (0.49) NR1I2PGRPPARGESR1TDP1
SCHEMBL10851118 0.93 NR1I2 (0.49) NR1I2PGRPPARGESR1TDP1
SCHEMBL10851122 0.93 NR1I2 (0.49) NR1I2PGRPPARGESR1TDP1
SCHEMBL10838819 0.91 NR1I2 (0.60) NR1I2PGRPPARGESR1TDP1
SCHEMBL10838814 0.91 NR1I2 (0.60) NR1I2PGRPPARGESR1TDP1
SCHEMBL10838309 0.90 KCNH2 (0.57) NR1I2PGRPPARGTDP1HSD17B10
SCHEMBL10838302 0.90 KCNH2 (0.57) NR1I2PGRPPARGTDP1HSD17B10
SCHEMBL10852690 0.90 NR1I2 (0.48) NR1I2PGRPPARGESR1TDP1

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
US-4567275-A 2-(5-AMINO-1,2,4-THIADIAZOL-3-YL)GLYOXYLIC ACID FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-28 — — US 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
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