SCHEMBL18012725

SCHEMBL18012725

CCCCCC/C(=N\OC(=O)c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C(C)=N/OC(=O)c3ccccc3)ccc1-2

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ CDK5 Q00535 1/20 0.42
▸ CDK5R1 Q15078 1/20 0.42
▸ PPARA Q07869 12/20 0.41
▸ PPARG P37231 11/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ RAB9A P51151 1/20 0.37
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL18012728 0.93 MAPT (0.42) MAPTPKMCDK5CDK5R1PPARA
SCHEMBL18012833 0.92 MAPT (0.40) MAPTPKMCDK5CDK5R1RAB9A
SCHEMBL18012785 0.89 PPARG (0.36) MAPTPKMPPARAPPARGMEN1
SCHEMBL18012727 0.88 MAPT (0.47) MAPTPKMCDK5CDK5R1MEN1
SCHEMBL18012710 0.88 MAPT (0.53) MAPTPKMCDK5CDK5R1MEN1
SCHEMBL18012726 0.84 MAPT (0.44) MAPTPKMCDK5CDK5R1PPARA
SCHEMBL18012829 0.82 CA2 (0.36) MAPTPKM
SCHEMBL18012704 0.81 SMN1; SMN2 (0.38) MAPTPKMCDK5CDK5R1PPARA
SCHEMBL18012797 0.80 KMT2A (0.36) MAPTPKMCDK5CDK5R1MEN1
SCHEMBL18012713 0.79 CDK5 (0.34) MAPTPKMCDK5CDK5R1MEN1

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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