SCHEMBL10529643

SCHEMBL10529643

CCON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(C=C(Br)Br)CS[C@@H]12)c1nsc(N)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.55
▸ TDP1 Q9NUW8 9/20 0.53
▸ APEX1 P27695 3/20 0.53
▸ APAF1 O14727 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ TSHR P16473 2/20 0.53
▸ PLCG1 P19174 1/20 0.53
▸ ABCC2 Q92887 1/20 0.53
▸ SIRT5 Q9NXA8 1/20 0.53
▸ PSMD14 O00487 1/20 0.52
▸ MMP2 P08253 1/20 0.52
▸ MAPT P10636 5/20 0.48
▸ ABCC4 O15439 2/20 0.48
▸ CNR1 P21554 1/20 0.48
▸ CTDSP1 Q9GZU7 1/20 0.48
▸ NR1I2 O75469 4/20 0.46
▸ ALB P02768 1/20 0.46
▸ PPARG P37231 1/20 0.46
▸ SLC22A6 Q4U2R8 1/20 0.46

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
SCHEMBL10529636 1.00 KCNH2 (0.55) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL10528730 0.92 KCNH2 (0.55) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL10528726 0.92 KCNH2 (0.55) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL10531216 0.90 KCNH2 (0.51) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL10815953 0.86 KCNH2 (0.55) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL10815936 0.86 KCNH2 (0.55) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL9781589 0.85 KCNH2 (0.56) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL10532741 0.85 KCNH2 (0.56) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL9781584 0.85 KCNH2 (0.56) KCNH2TDP1APEX1APAF1LMNA
SCHEMBL7961807 0.85 KCNH2 (0.56) KCNH2TDP1APEX1APAF1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0109683-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-10-11 — — EP claimed
EP-0109683-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-05-30 — — EP claimed
EP-0109683-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-10-11 — — EP disclosed
US-4609730-A CEPHALOSPORIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-09-02 — — US disclosed
EP-0109683-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-05-30 — — EP disclosed
Send feedback