SCHEMBL8045998

SCHEMBL8045998

CC(O[Si](C)(C)C)C1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)=C([S+]([O-])c3ccccc3C(=O)N3CCCCCC3)C(C)[C@@H]12

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
PLCG1 P19174 1/20 0.36
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
NPC1 O15118 3/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
AR P10275 2/20 0.33
PAX8 Q06710 1/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 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
SCHEMBL8038903 0.91 PLCG1 (0.38) DPP8DPP9PLCG1RAB9ASMN1; SMN2
SCHEMBL8039578 0.87 L3MBTL1 (0.36) PLCG1RAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL8046094 0.85 LMNA (0.45) DPP8DPP9PLCG1RAB9ASMN1; SMN2
SCHEMBL8042511 0.85 DPP8 (0.36) DPP8DPP9PLCG1RAB9ASMN1; SMN2
SCHEMBL8046000 0.78 ELANE (0.38) PLCG1RAB9ASMN1; SMN2L3MBTL1POLB
SCHEMBL8834929 0.77 SMN1; SMN2 (0.31) SMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL8042493 0.77 SMN1; SMN2 (0.31) SMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL8042506 0.76 LMNA (0.48) DPP8DPP9PLCG1RAB9ASMN1; SMN2
SCHEMBL8040724 0.76 PLCG1 (0.38) DPP8DPP9PLCG1RAB9ASMN1; SMN2
SCHEMBL9026674 0.76 PLCG1 (0.40) PLCG1RAB9ASMN1; SMN2L3MBTL1POLB

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-5614624-A THIO SUBSTITUTED, ANTIBIOTICS, CHEMICAL INTERMEDIATES SANKYO COMPANY, LIMITED (JP) 1997-03-25 US claimed
EP-0587436-A1 Process for preparing carbapenem and penem compounds and new compounds involved in that process SANKYO COMPANY LIMITED (JP) 1994-03-16 EP claimed
EP-0587436-B1 Process for preparing carbapenem and penem compounds and new compounds involved in that process SANKYO CO (JP) 2000-05-10 EP disclosed
US-5719275-A REACTING SILYL ENOL ETHER WITH AZETIDINONE DERIVATIVE TO FORM INTERMEDIATE FOR PENICILLIN-TYPE ANTIBIOTIC SANKYO COMPANY, LIMITED (JP) 1998-02-17 US disclosed
US-5681951-A REACTING PENICILLIN DERIVATIVE HAVING SULFINYL OR SULFONYL GROUP IN 2 POSITION WITH SUBSTITUTED MERCAPTAN IN PRESENCE OF SALT OF GROUP IIA OR IIIA ELEMENT SANKYO COMPANY, LIMITED (JP) 1997-10-28 US disclosed
US-5614624-A THIO SUBSTITUTED, ANTIBIOTICS, CHEMICAL INTERMEDIATES SANKYO COMPANY, LIMITED (JP) 1997-03-25 US disclosed
US-5541317-A PENICILLIN DERIVATIVES, CYCLIZATION OF ESTERS OR THIOESTERS SANKYO COMPANY, LIMITED (JP) 1996-07-30 US disclosed
EP-0587436-A1 Process for preparing carbapenem and penem compounds and new compounds involved in that process SANKYO COMPANY LIMITED (JP) 1994-03-16 EP disclosed