SCHEMBL18012762

SCHEMBL18012762

CCCCCC(=N\OC(C)=O)/C(=N\OC(C)=O)c1ccc2c(c1)C(CC)(CC)c1cc(C(=N/OC(C)=O)/C(C)=N/OC(C)=O)ccc1-2

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 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
SCHEMBL18012713 0.89 CDK5 (0.34) —
SCHEMBL18012646 0.88 PKM (0.34) —
SCHEMBL18012761 0.87 KMT2A (0.31) ALDH1A1
SCHEMBL18012835 0.86 RAB9A (0.37) ALDH1A1
SCHEMBL18012825 0.84 PDK2 (0.32) —
SCHEMBL18012754 0.83 PDK2 (0.38) —
SCHEMBL24490482 0.81 PDK2 (0.36) —
SCHEMBL21431242 0.81 HSD17B3 (0.31) —
SCHEMBL18012829 0.78 CA2 (0.36) —
SCHEMBL18012814 0.78 MAPT (0.38) —

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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