SCHEMBL10849309

SCHEMBL10849309

Nc1nc(C(=NOC2CCCC2)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4ncns4)CS[C@@H]23)ns1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 4/20 0.48
▸ PGR P06401 2/20 0.48
▸ PPARG P37231 2/20 0.48
▸ SLC22A6 Q4U2R8 2/20 0.48
▸ SLC22A8 Q8TCC7 2/20 0.48
▸ SLC22A11 Q9NSA0 2/20 0.48
▸ DAO P14920 1/20 0.48
▸ SNCA P37840 1/20 0.48
▸ CYP2J2 P51589 1/20 0.48
▸ ABCC4 O15439 1/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ MAPT P10636 4/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ ALB P02768 1/20 0.45
▸ TDP1 Q9NUW8 4/20 0.43
▸ APEX1 P27695 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ CYP2D6 P10635 1/20 0.43

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
SCHEMBL10849306 1.00 NR1I2 (0.48) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10837193 0.91 NR1I2 (0.59) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10837198 0.91 NR1I2 (0.59) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10854893 0.90 NR1I2 (0.50) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10854885 0.90 NR1I2 (0.50) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10859944 0.89 NR1I2 (0.49) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL10859950 0.89 NR1I2 (0.49) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL11087914 0.88 POLB (0.55) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL11087923 0.88 POLB (0.55) NR1I2PGRPPARGSLC22A6SLC22A8
SCHEMBL9705515 0.87 NR1I2 (0.63) 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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