SCHEMBL10890519

SCHEMBL10890519

Nc1nc(CC(=O)NC2C(=O)N3C(C(=O)OC(c4ccccc4)c4ccccc4)=C(/C=C/Cl)CS[C@H]23)cs1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 9/20 0.44
▸ HPGD P15428 4/20 0.44
▸ HSD17B10 Q99714 5/20 0.44
▸ LMNA P02545 3/20 0.44
▸ MAPT P10636 6/20 0.44
▸ POLB P06746 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ DUSP3 P51452 1/20 0.44
▸ PTPN5 P54829 1/20 0.44
▸ PTPN11 Q06124 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ ALDH1A1 P00352 7/20 0.42
▸ KDM4E B2RXH2 4/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ CTDSP1 Q9GZU7 2/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ SLC15A2 Q16348 2/20 0.42

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
SCHEMBL10890522 1.00 TDP1 (0.44) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL9481794 0.91 TDP1 (0.55) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL9481784 0.91 TDP1 (0.55) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL10892443 0.86 TDP1 (0.54) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL10892425 0.86 TDP1 (0.54) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL10893628 0.84 TDP1 (0.62) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL10893625 0.84 TDP1 (0.62) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL10893639 0.84 TDP1 (0.62) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL8867412 0.84 TDP1 (0.53) TDP1HPGDHSD17B10LMNAMAPT
SCHEMBL8867421 0.84 TDP1 (0.53) TDP1HPGDHSD17B10LMNAMAPT

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-4631274-A MICROBIOCIDES FUJISAWA PHARMCEUTICAL CO., LTD. (JP) 1986-12-23 — — US disclosed
EP-0154354-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-09-11 — — EP disclosed
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