SCHEMBL11038320

SCHEMBL11038320

CC(C)(C)OC(=O)CO/N=C(\C(=O)NC1C(=O)N2C(C(=O)O)=C(Cl)CS[C@H]12)c1ncsn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.44
▸ APAF1 O14727 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ PLCG1 P19174 1/20 0.44
▸ ABCC2 Q92887 1/20 0.44
▸ SIRT5 Q9NXA8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PSMD14 O00487 1/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ NR1I2 O75469 4/20 0.42
▸ HTR2C P28335 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 4/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ HSD17B10 Q99714 4/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ HPGD P15428 2/20 0.41

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
SCHEMBL11038323 1.00 TDP1 (0.44) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11039905 0.90 TDP1 (0.53) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11039908 0.90 TDP1 (0.53) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10643010 0.90 TDP1 (0.43) TDP1APAF1LMNATSHRAPEX1
SCHEMBL10643005 0.90 TDP1 (0.43) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11040896 0.89 TDP1 (0.58) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11040894 0.89 TDP1 (0.58) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11039500 0.88 MAPT (0.56) TDP1LMNATSHRAPEX1L3MBTL1
SCHEMBL11089492 0.87 KCNH2 (0.49) TDP1APAF1LMNATSHRAPEX1
SCHEMBL11089490 0.87 KCNH2 (0.49) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4464369-A CEPHALOSPORINS, ANTIMICROBIALS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-08-07 — — US claimed
EP-0088385-A2 7-Acylamino-3-cephem-4-carboxylic acid derivatives, processes for the preparation of the same and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-09-14 — — EP claimed
US-4464369-A CEPHALOSPORINS, ANTIMICROBIALS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-08-07 — — US disclosed
EP-0088385-A2 7-Acylamino-3-cephem-4-carboxylic acid derivatives, processes for the preparation of the same and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-09-14 — — EP disclosed
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