SCHEMBL10787995

SCHEMBL10787995

C#CCn1nnnc1SCC1(C(=O)O)CS[C@@H]2C(NC(=O)C(=NOCC(=O)OC(C)(C)C)c3nsc(N)n3)C(=O)N2C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.34
▸ NR1I2 O75469 1/20 0.33
▸ PGR P06401 1/20 0.33

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
SCHEMBL10785086 0.93 KCNH2 (0.34) KCNH2NR1I2PGR
SCHEMBL10854213 0.91 NR1I2 (0.35) KCNH2NR1I2PGR
SCHEMBL10784180 0.91 NR1I2 (0.40) KCNH2NR1I2PGR
SCHEMBL10849152 0.91 KCNH2 (0.35) KCNH2NR1I2PGR
SCHEMBL10850677 0.90 NR1I2 (0.34) KCNH2NR1I2PGR
Hydrochloric Acid SCHEMBL10784730 0.89 NR1I2 (0.45) NR1I2PGR
SCHEMBL10858830 0.89 KCNH2 (0.34) KCNH2NR1I2PGR
SCHEMBL10787141 0.88 NR1I2 (0.33) KCNH2NR1I2PGR
SCHEMBL10847932 0.87 KCNH2 (0.36) KCNH2NR1I2PGR
SCHEMBL10853816 0.87 KCNH2 (0.34) KCNH2NR1I2PGR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0126859-B1 INTERMEDIATE COMPOUNDS FOR PREPARING CEPHEM COMPOUNDS AND PROCESSES FOR THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-08-19 — — EP disclosed
US-4563450-A CEPHALOSPORINS, MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-07 — — US disclosed
US-4405617-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-09-20 — — US disclosed
EP-0033965-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-08-19 — — EP disclosed
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