SCHEMBL11278431

SCHEMBL11278431

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.51
▸ APAF1 O14727 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ APEX1 P27695 1/20 0.51
▸ PLCG1 P19174 1/20 0.51
▸ ABCC2 Q92887 1/20 0.51
▸ SIRT5 Q9NXA8 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PSMD14 O00487 1/20 0.50
▸ MMP2 P08253 1/20 0.50
▸ MAPT P10636 5/20 0.48
▸ NR1I2 O75469 5/20 0.48
▸ KDM4E B2RXH2 4/20 0.48
▸ ALDH1A1 P00352 4/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ HPGD P15428 2/20 0.48
▸ CYP3A4 P08684 2/20 0.48

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
SCHEMBL11278429 1.00 TDP1 (0.51) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10531390 0.91 TDP1 (0.53) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10531398 0.91 TDP1 (0.53) TDP1APAF1LMNATSHRAPEX1
SCHEMBL9481299 0.91 TDP1 (0.63) TDP1APAF1LMNATSHRAPEX1
SCHEMBL9481301 0.91 TDP1 (0.63) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10345545 0.90 TDP1 (0.49) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10528977 0.90 TDP1 (0.49) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10345544 0.90 TDP1 (0.49) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10528972 0.90 TDP1 (0.49) TDP1APAF1LMNATSHRAPEX1
SCHEMBL8869412 0.90 KMT2A (0.50) TDP1APAF1LMNATSHRAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048915-A2 New cephem compounds, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-04-07 — — EP disclosed
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