SCHEMBL10875895

SCHEMBL10875895

Nc1nc(C(=NOCC(=O)OC(c2ccccc2)c2ccccc2)C(=O)NC2C(=O)N3C(C(=O)O)=C(Cl)CS[C@@H]23)cs1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.62
▸ APAF1 O14727 2/20 0.62
▸ LMNA P02545 2/20 0.62
▸ TSHR P16473 1/20 0.62
▸ APEX1 P27695 1/20 0.62
▸ PLCG1 P19174 1/20 0.62
▸ ABCC2 Q92887 1/20 0.62
▸ SIRT5 Q9NXA8 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.62
▸ PSMD14 O00487 1/20 0.61
▸ MMP2 P08253 1/20 0.61
▸ NR1I2 O75469 6/20 0.58
▸ HTR2C P28335 1/20 0.58
▸ MAPT P10636 5/20 0.56
▸ PPARG P37231 2/20 0.56
▸ SLC22A6 Q4U2R8 2/20 0.56
▸ SLC22A8 Q8TCC7 2/20 0.56
▸ SLC22A11 Q9NSA0 2/20 0.56
▸ ALB P02768 1/20 0.56
▸ KMT2A Q03164 3/20 0.54

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
SCHEMBL11285168 0.94 TDP1 (0.56) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11282014 0.94 TDP1 (0.56) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10529009 0.90 TDP1 (0.66) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10529018 0.90 TDP1 (0.66) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10643291 0.90 TDP1 (0.60) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10890534 0.90 TDP1 (0.60) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10532610 0.90 TDP1 (0.60) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10644623 0.90 TDP1 (0.60) TDP1APAF1LMNATSHRAPEX1
SCHEMBL8868312 0.89 NR1I2 (0.62) TDP1APAF1LMNATSHRAPEX1
SCHEMBL8868304 0.89 NR1I2 (0.62) 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-B1 NEW CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-28 — — EP disclosed
Send feedback