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SCHEMBL9660442

SCHEMBL9660442

C[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1C(=O)N2C(C(=O)O)=C(CS(=O)(=O)c3ccc(F)cc3F)C[C@H]12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ APLNR P35414 2/20 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
SCHEMBL9082817 0.84 KDM4E (0.41) PTGDR2KDM4ELMNA
SCHEMBL9317033 0.83 PTGDR2 (0.34) PTGDR2KDM4ELMNA
SCHEMBL9318537 0.74 KDM4E (0.33) KDM4ELMNA
SCHEMBL9082540 0.74 PTGDR2 (0.30) PTGDR2
SCHEMBL9428729 0.73 KDM4E (0.42) KDM4ELMNA
SCHEMBL8835026 0.72 KDM4E (0.39) KDM4ELMNA
SCHEMBL8038866 0.70 KDM4E (0.32) KDM4ELMNA
SCHEMBL9194444 0.69 ELANE (0.31) —
SCHEMBL9083998 0.68 PTGDR2 (0.33) PTGDR2
SCHEMBL9699187 0.68 FAAH (0.33) KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0478874-A2 Novel 2-substituted alkyl-3-carboxy carbapenems as antibiotics and a method of producing them AMERICAN CYANAMID COMPANY (US) 1992-04-08 — — EP claimed
EP-0478874-A2 Novel 2-substituted alkyl-3-carboxy carbapenems as antibiotics and a method of producing them AMERICAN CYANAMID COMPANY (US) 1992-04-08 — — EP disclosed
US-5068232-A Bactericides AMERICAN CYANAMID COMPANY (US) 1991-11-26 — — US disclosed