SCHEMBL10529990

SCHEMBL10529990

CCO/N=C(/C(=O)NC1C(=O)N2C=C(C[PH](c3ccccc3)(c3ccccc3)c3ccccc3)CS[C@H]12)c1nsc(N)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.48
▸ TDP1 Q9NUW8 8/20 0.36
▸ APEX1 P27695 3/20 0.36
▸ APAF1 O14727 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ PLCG1 P19174 1/20 0.36
▸ ABCC2 Q92887 1/20 0.36
▸ SIRT5 Q9NXA8 1/20 0.36
▸ PSMD14 O00487 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ NR1I2 O75469 6/20 0.35
▸ PGR P06401 3/20 0.35
▸ PPARG P37231 2/20 0.35
▸ ESR1 P03372 2/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ HSD17B10 Q99714 4/20 0.35
▸ KMT2A Q03164 1/20 0.34
▸ MAPT P10636 3/20 0.34

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
SCHEMBL10529997 1.00 KCNH2 (0.48) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL11040792 0.85 KCNH2 (0.51) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10838332 0.84 KCNH2 (0.52) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10780751 0.82 KCNH2 (0.51) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10777263 0.82 KCNH2 (0.49) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10782260 0.82 KCNH2 (0.49) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10528793 0.81 KCNH2 (0.49) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10528853 0.80 KCNH2 (0.48) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10777276 0.80 KCNH2 (0.49) KCNH2TDP1APEX1APAF1TSHR
SCHEMBL10530869 0.80 KCNH2 (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0103264-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-12-20 — — EP disclosed
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