SCHEMBL10855975

SCHEMBL10855975

Cn1c(SCC2=C(C(=O)O)N3C(=O)C(NC(=O)C(=NOC4CCCC4)c4nsc(N)n4)[C@@H]3SC2)nnc(O)c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 5/20 0.51
▸ PGR P06401 3/20 0.51
▸ PPARG P37231 3/20 0.49
▸ SLC22A6 Q4U2R8 3/20 0.49
▸ SLC22A8 Q8TCC7 3/20 0.49
▸ SLC22A11 Q9NSA0 3/20 0.49
▸ DAO P14920 1/20 0.49
▸ SNCA P37840 1/20 0.49
▸ CYP2J2 P51589 1/20 0.49
▸ ABCC4 O15439 1/20 0.48
▸ MAPT P10636 5/20 0.44
▸ TDP1 Q9NUW8 4/20 0.44
▸ POLB P06746 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ BLM P54132 1/20 0.44

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
SCHEMBL10855972 1.00 NR1I2 (0.51) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10854215 0.91 NR1I2 (0.53) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10854206 0.91 NR1I2 (0.53) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10857920 0.89 NR1I2 (0.65) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10857928 0.89 NR1I2 (0.65) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL11115825 0.87 NR1I2 (0.47) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL11115828 0.87 NR1I2 (0.47) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL11085672 0.86 NR1I2 (0.56) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL11085669 0.86 NR1I2 (0.56) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10857087 0.85 NR1I2 (0.55) NR1I2PGRPPARGSLC22A6SLC22A8

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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