SCHEMBL11225757

SCHEMBL11225757

CC(=O)OC=C1S[C@H]2C(NC(=O)COc3ccccc3)C(=O)N2C(C(=O)OCc2ccc([N+](=O)[O-])cc2)=C1COC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PLCG1 P19174 1/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ TDP1 Q9NUW8 3/20 0.41
▸ CTDSP1 Q9GZU7 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ DNMT1 P26358 1/20 0.37
▸ SLC22A6 Q4U2R8 1/20 0.37
▸ SLC22A8 Q8TCC7 1/20 0.37
▸ SLC22A11 Q9NSA0 1/20 0.37

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
SCHEMBL11225729 1.00 PLCG1 (0.52) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11224879 0.93 PLCG1 (0.51) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11224877 0.93 PLCG1 (0.51) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11222938 0.92 PLCG1 (0.53) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11222935 0.92 PLCG1 (0.53) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11226408 0.92 PLCG1 (0.55) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11226411 0.92 PLCG1 (0.55) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11227030 0.85 TDP1 (0.53) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11227032 0.85 TDP1 (0.53) PLCG1L3MBTL1TDP1CTDSP1ALDH1A1
SCHEMBL11260113 0.84 PLCG1 (0.63) PLCG1L3MBTL1CTDSP1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4334064-A Cephalosporin vinyl halides ELI LILLY AND COMPANY (US) 1982-06-08 — — US disclosed
US-4334063-A Cephalosporin vinyl halides ELI LILLY AND COMPANY (US) 1982-06-08 — — US disclosed
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