SCHEMBL10531114

SCHEMBL10531114

O=CNc1nc(C(=NOCC(=O)OC(c2ccccc2)c2ccccc2)C(=O)NC2C(=O)N3C(C(=O)O)=C(C=C(Br)Br)CS[C@@H]23)cs1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 0.53
▸ APEX1 P27695 3/20 0.53
▸ APAF1 O14727 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ TSHR P16473 1/20 0.53
▸ PLCG1 P19174 1/20 0.53
▸ ABCC2 Q92887 1/20 0.53
▸ SIRT5 Q9NXA8 1/20 0.53
▸ PSMD14 O00487 1/20 0.53
▸ MMP2 P08253 1/20 0.53
▸ MAPT P10636 5/20 0.45
▸ ABCC4 O15439 3/20 0.45
▸ CNR1 P21554 1/20 0.45
▸ CTDSP1 Q9GZU7 1/20 0.45
▸ NR1I2 O75469 5/20 0.44
▸ PPARG P37231 2/20 0.44
▸ SLC22A6 Q4U2R8 2/20 0.44
▸ SLC22A8 Q8TCC7 2/20 0.44
▸ SLC22A11 Q9NSA0 2/20 0.44

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
SCHEMBL10531100 1.00 TDP1 (0.53) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL10531398 0.94 TDP1 (0.53) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL10531390 0.94 TDP1 (0.53) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL9481301 0.92 TDP1 (0.63) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL9481299 0.92 TDP1 (0.63) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL10530989 0.91 TDP1 (0.66) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL10530996 0.91 TDP1 (0.66) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL11278429 0.90 TDP1 (0.51) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL11278431 0.90 TDP1 (0.51) TDP1APEX1APAF1LMNAL3MBTL1
SCHEMBL10528972 0.88 TDP1 (0.49) TDP1APEX1APAF1LMNAL3MBTL1

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-0109683-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-10-11 — — EP disclosed
US-4609730-A CEPHALOSPORIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-09-02 — — US disclosed
EP-0109683-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-05-30 — — EP disclosed
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