SCHEMBL10815936

SCHEMBL10815936

CCO/N=C(\C(=O)NC1C(=O)N2C(C(=O)O)=C(/C=C/c3ccncc3)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 6/20 0.51
▸ APAF1 O14727 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ APEX1 P27695 1/20 0.51
▸ PLCG1 P19174 1/20 0.51
▸ ABCC2 Q92887 1/20 0.51
▸ SIRT5 Q9NXA8 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PSMD14 O00487 1/20 0.51
▸ MMP2 P08253 1/20 0.51
▸ MAPT P10636 5/20 0.46
▸ ABCC4 O15439 1/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ CTDSP1 Q9GZU7 1/20 0.46
▸ NR1I2 O75469 4/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ ALB P02768 1/20 0.43
▸ PPARG P37231 1/20 0.43

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
SCHEMBL10815953 1.00 KCNH2 (0.55) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10531041 0.92 KCNH2 (0.52) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10531342 0.92 KCNH2 (0.52) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10796556 0.92 KCNH2 (0.52) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10796352 0.89 KCNH2 (0.54) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10796339 0.89 KCNH2 (0.54) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10796435 0.86 TDP1 (0.52) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10796441 0.86 TDP1 (0.52) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10796180 0.86 TDP1 (0.56) KCNH2TDP1APAF1TSHRLMNA
SCHEMBL10367567 0.86 KCNH2 (0.53) KCNH2TDP1APAF1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4639448-A 7-amino-3-[substituted vinyl]-3-cephem-4-carboxylates having antimicrobial activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-01-27 — — US disclosed
US-4546101-A CEPHALOSPORINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-10-08 — — US disclosed
EP-0103264-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-03-21 — — EP disclosed
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