SCHEMBL10644836

SCHEMBL10644836

CCSC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOCC(=O)O)c3nsc(N)n3)[C@@H]2SC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.55
▸ TDP1 Q9NUW8 7/20 0.54
▸ APEX1 P27695 3/20 0.54
▸ APAF1 O14727 2/20 0.54
▸ TSHR P16473 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ PLCG1 P19174 1/20 0.54
▸ ABCC2 Q92887 1/20 0.54
▸ SIRT5 Q9NXA8 1/20 0.54
▸ PSMD14 O00487 1/20 0.53
▸ MMP2 P08253 1/20 0.53
▸ NR1I2 O75469 5/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ MAPT P10636 4/20 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
▸ ALB P02768 1/20 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
SCHEMBL10644834 1.00 KCNH2 (0.55) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10643898 0.92 TDP1 (0.55) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10643619 0.92 TDP1 (0.55) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10643606 0.91 KCNH2 (0.52) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10643602 0.91 KCNH2 (0.52) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10647685 0.89 KCNH2 (0.51) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10646204 0.89 KCNH2 (0.51) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10646207 0.89 KCNH2 (0.51) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL11082844 0.88 TDP1 (0.57) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL11082838 0.88 TDP1 (0.57) KCNH2TDP1APEX1APAF1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0057422-B1 NEW CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-10-12 — — EP claimed
US-4452851-A BACTERICIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-06-05 — — US claimed
EP-0057422-A2 New cephem compounds, processes for preparation thereof and pharmaceutical composition containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-08-11 — — EP claimed
EP-0057422-B1 NEW CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-10-12 — — EP disclosed
EP-0191507-A2 New 2-oxyimino-3-oxobutyric acid derivatives and process for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-08-20 — — EP disclosed
US-4452851-A BACTERICIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-06-05 — — US disclosed
EP-0057422-A2 New cephem compounds, processes for preparation thereof and pharmaceutical composition containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-08-11 — — EP disclosed
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