SCHEMBL10847932

SCHEMBL10847932

CC(C)(C)OC(=O)CON=C(C(=O)NC1C(=O)N2CC(CSc3nnnn3-c3ccccc3)(C(=O)O)CS[C@H]12)c1nsc(N)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.36
▸ NR1I2 O75469 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ ALDH1A1 P00352 9/20 0.33
▸ TSHR P16473 6/20 0.33
▸ KMT2A Q03164 5/20 0.33
▸ MAPT P10636 4/20 0.33
▸ USP2 O75604 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32
▸ RELA Q04206 1/20 0.32
▸ HPGD P15428 3/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ NTRK1 P04629 2/20 0.31
▸ NTRK2 Q16620 2/20 0.31
▸ MEN1 O00255 3/20 0.31

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
SCHEMBL10851705 0.93 KCNH2 (0.37) KCNH2NR1I2PGRALDH1A1TSHR
SCHEMBL10854213 0.88 NR1I2 (0.35) KCNH2NR1I2PGRTSHRHSD17B10
SCHEMBL10787995 0.87 KCNH2 (0.34) KCNH2NR1I2PGR
SCHEMBL10849152 0.87 KCNH2 (0.35) KCNH2NR1I2PGRTSHRLMNA
SCHEMBL10850531 0.87 KCNH2 (0.35) KCNH2NR1I2PGRTSHRLMNA
SCHEMBL10850677 0.86 NR1I2 (0.34) KCNH2NR1I2PGR
SCHEMBL10858830 0.85 KCNH2 (0.34) KCNH2NR1I2PGR
SCHEMBL10855776 0.85 KCNH2 (0.39) KCNH2NR1I2PGRTSHRHSD17B10
SCHEMBL10848693 0.83 NR1I2 (0.42) KCNH2NR1I2PGRALDH1A1MAPT
SCHEMBL10854017 0.83 KCNH2 (0.36) KCNH2NR1I2PGRTSHRKMT2A

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 8 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
Send feedback