SCHEMBL11302146

SCHEMBL11302146

O=C(Cc1cccs1)NC1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)=C(Cl)CS[C@@H]12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLCG1 P19174 1/20 0.65
▸ TDP1 Q9NUW8 6/20 0.56
▸ MAPT P10636 6/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ HPGD P15428 3/20 0.56
▸ HSD17B10 Q99714 3/20 0.56
▸ LMNA P02545 3/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ POLB P06746 3/20 0.56
▸ CYP3A4 P08684 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ GLA P06280 1/20 0.56
▸ APEX1 P27695 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ PTPN7 P35236 1/20 0.56
▸ BLM P54132 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ NAPEPLD Q6IQ20 1/20 0.55
▸ CTDSP1 Q9GZU7 3/20 0.55

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
SCHEMBL11302144 1.00 PLCG1 (0.65) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11098917 0.92 PLCG1 (0.67) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11304944 0.92 PLCG1 (0.67) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL10990303 0.91 PLCG1 (0.65) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11304937 0.91 PLCG1 (0.65) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11100125 0.91 PLCG1 (0.79) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11654500 0.91 PLCG1 (0.79) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11311726 0.91 PLCG1 (0.65) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11304935 0.91 PLCG1 (0.65) PLCG1TDP1MAPTMEN1KMT2A
SCHEMBL11311729 0.91 PLCG1 (0.65) PLCG1TDP1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4281116-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1981-07-28 — — US disclosed
US-4260745-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1981-04-07 — — US disclosed
US-4252950-A ANTIBIOTICS, BACTERICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1981-02-24 — — US disclosed
US-4208515-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1980-06-17 — — US disclosed
US-4065618-A Process for 3-H-3-cephem esters ELI LILLY AND COMPANY (US) 1977-12-27 — — US disclosed
US-4065621-A Process for 3-alkyl and 3-phenyl cephalosporins ELI LILLY AND COMPANY (US) 1977-12-27 — — US disclosed
US-4064343-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1977-12-20 — — US disclosed
US-4060688-A Cephalosporin intermediates ELI LILLY AND COMPANY (US) 1977-11-29 — — US disclosed
US-4013651-A 3-SUBSTITUTED AMINO-CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1977-03-22 — — US disclosed
US-3992377-A 3-Thio-substituted cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1976-11-16 — — US disclosed
US-3992377-A 3-Thio-substituted cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1976-11-16 — — US disclosed
US-3962227-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1976-06-08 — — US disclosed
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