SCHEMBL10851072

SCHEMBL10851072

Cn1nnnc1SCC1(C(=O)O)CS[C@@H]2C(NC(=O)C(=NOc3ccc(F)cc3)c3nsc(N)n3)C(=O)N2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 2/20 0.41
▸ PGR P06401 2/20 0.41
▸ KCNH2 Q12809 1/20 0.35
▸ PPARG P37231 1/20 0.32
▸ SLC22A6 Q4U2R8 1/20 0.32
▸ SLC22A8 Q8TCC7 1/20 0.32
▸ SLC22A11 Q9NSA0 1/20 0.32
▸ TDP1 Q9NUW8 7/20 0.32
▸ HSD17B10 Q99714 5/20 0.32
▸ ALDH1A1 P00352 7/20 0.32
▸ MAPT P10636 6/20 0.32
▸ POLB P06746 5/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ APEX1 P27695 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ PTPN7 P35236 1/20 0.31
▸ SMN1; SMN2 Q16637 3/20 0.30

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
SCHEMBL10848693 0.94 NR1I2 (0.42) NR1I2PGRKCNH2PPARGSLC22A6
SCHEMBL10853831 0.94 NR1I2 (0.41) NR1I2PGRKCNH2PPARGSLC22A6
SCHEMBL10854588 0.93 NR1I2 (0.35) NR1I2PGRKCNH2TDP1HSD17B10
SCHEMBL10849756 0.93 NR1I2 (0.34) NR1I2PGRKCNH2TDP1HSD17B10
SCHEMBL10853127 0.92 NR1I2 (0.34) NR1I2PGRKCNH2TDP1HSD17B10
SCHEMBL10850218 0.91 KCNH2 (0.33) NR1I2PGRKCNH2TDP1APEX1
SCHEMBL11357586 0.89 NR1I2 (0.49) NR1I2PGRKCNH2PPARGSLC22A6
SCHEMBL10859765 0.89 NR1I2 (0.39) NR1I2PGRKCNH2PPARGSLC22A6
SCHEMBL10853151 0.89 KCNH2 (0.33) NR1I2PGRKCNH2
SCHEMBL10840189 0.88 NR1I2 (0.42) NR1I2PGRKCNH2PPARGSLC22A6

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
Send feedback