SCHEMBL6861008

SCHEMBL6861008

C/C(N)=C/C(=O)OC(C)C(C)OC(=O)/C=C(/C)N

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
ALOX15 P16050 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
TSHR P16473 2/20 0.35
HCAR2 Q8TDS4 1/20 0.32
OPRK1 P41145 2/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
CYP2C9 P11712 1/20 0.30
PRKCA P17252 1/20 0.30

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
SCHEMBL489372 0.86 HCAR2 (0.46) LMNAALOX15BLMPMP22TSHR
SCHEMBL489374 0.86 HCAR2 (0.46) LMNAALOX15BLMPMP22TSHR
SCHEMBL8521397 0.86 HCAR2 (0.46) LMNAALOX15BLMPMP22TSHR
SCHEMBL21680864 0.80 TSHR (0.31) TSHR
SCHEMBL9674283 0.80 TSHR (0.31) TSHR
SCHEMBL10589861 0.80 TSHR (0.31) TSHR
SCHEMBL9674276 0.80 TSHR (0.31) TSHR
SCHEMBL11737645 0.79 CHRNB2 (0.32) TSHR
SCHEMBL9175586 0.79 TSHR (0.34) LMNABLMTSHROPRK1CHRM2
SCHEMBL9175611 0.79 TSHR (0.34) LMNABLMTSHROPRK1CHRM2

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-1368423-B1 CHLORATE-CONTAINING STABILIZER SYSTEM WITH NITROGEN-CONTAINING SYNERGISTS FOR STABILIZING HALOGEN-CONTAINING POLYMERS CROMPTON VINYL ADDITIVES GMBH (DE) 2004-12-01 EP disclosed