SCHEMBL8664795

SCHEMBL8664795

O=C(Cc1ccccc1)NC1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)=C(Cl)CS[C@H]12

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLCG1 P19174 1/20 0.81
▸ ALDH1A1 P00352 5/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ TDP1 Q9NUW8 5/20 0.55
▸ MAPK1 P28482 1/20 0.54
▸ CTDSP1 Q9GZU7 2/20 0.53
▸ MAPT P10636 4/20 0.51
▸ POLB P06746 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ DUSP3 P51452 1/20 0.51
▸ PTPN5 P54829 1/20 0.51
▸ PTPN11 Q06124 1/20 0.51
▸ SIGMAR1 Q99720 2/20 0.46
▸ KDM4E B2RXH2 4/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45

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
SCHEMBL11512916 1.00 PLCG1 (0.81) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL8664798 1.00 PLCG1 (0.81) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL9623844 0.91 PLCG1 (0.80) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL9623847 0.91 PLCG1 (0.80) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL8766584 0.91 PLCG1 (0.83) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL8766580 0.91 PLCG1 (0.83) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL28528206 0.91 PLCG1 (0.83) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL11880315 0.90 PLCG1 (0.68) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL8664694 0.90 PLCG1 (0.67) PLCG1ALDH1A1L3MBTL1TDP1MAPK1
SCHEMBL11674207 0.90 PLCG1 (0.67) PLCG1ALDH1A1L3MBTL1TDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745603-B1 Process for p-nitrobenzyl ester cleavage in cephalosporin RANBAXY LAB LTD (IN) 1998-12-02 — — EP disclosed
EP-0745603-A1 Process for p-nitrobenzyl ester cleavage in cephalosporin Ranbaxy Laboratories Limited (IN) 1996-12-04 — — EP disclosed
US-5536830-A Process for P-nitrobenzyl ester cleavage in cephalosporin RANBAXY LABORATORIES, LTD. (IN) 1996-07-16 — — US disclosed
US-5532353-A Process for the preparation of halogenated β-lactam compounds BIOCHIMICA OPOS SPA (IT) 1996-07-02 — — US disclosed
EP-0570058-A2 Process for the preparation of halogenated beta-lactam compounds BIOCHIMICA OPOS SPA (IT) 1993-11-18 — — EP disclosed
EP-0015079-B1 HALOGENATING COMPOUNDS AND A PROCESS FOR THEIR PRODUCTION ELI LILLY AND COMPANY (US) 1987-09-09 — — EP disclosed
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-4230644-A DERIVED FROM TRIARYL PHOSPHITES AND CHLORINE OR BROMINE ELI LILLY AND COMPANY (US) 1980-10-28 — — US disclosed
US-4208515-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1980-06-17 — — US disclosed
US-4091214-A ALPHA-HYDROXY CARBOXYLIC ACID ELI LILLY AND COMPANY (US) 1978-05-23 — — US disclosed
US-4064343-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1977-12-20 — — US disclosed
US-3962227-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1976-06-08 — — US disclosed
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