SCHEMBL18012640

SCHEMBL18012640

CCC1(CC)c2cc(C(=N/O)/C(C)=N/O)ccc2-c2ccc(C(=N/O)/C(C)=N/O)cc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.33
▸ PDK2 Q15119 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
SCHEMBL18012757 0.93 PDK2 (0.37) PDK2
SCHEMBL18012712 0.86 TRPA1 (0.31) —
SCHEMBL18012644 0.83 MAPT (0.48) PDK2
SCHEMBL18012641 0.82 KDM4E (0.45) HSD17B10
SCHEMBL18012715 0.82 HCAR3 (0.37) —
SCHEMBL29089351 0.77 POLB (0.43) PDK2
SCHEMBL30617329 0.77 POLB (0.43) PDK2
SCHEMBL18235861 0.77 POLB (0.43) PDK2
SCHEMBL18012639 0.75 NPC1 (0.52) PDK2
SCHEMBL18012646 0.75 PKM (0.34) PDK2

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
WO-2016126070-A1 NOVEL OXIMESTER DERIVATIVE COMPOUND, AND PHOTOPOLYMERIZATION INITIATOR AND PHOTORESIST COMPOSITION CONTAINING SAME 한국화학연구원 2016-08-11 — — WO disclosed
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