SCHEMBL18012774

SCHEMBL18012774

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

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.35
▸ PDE4B Q07343 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ PDK2 Q15119 8/20 0.33
▸ PKM P14618 2/20 0.33
▸ MAPT P10636 2/20 0.32
▸ NPY1R P25929 1/20 0.32
▸ NPY2R P49146 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CDK5 Q00535 1/20 0.31
▸ CDK5R1 Q15078 1/20 0.31
▸ ESR1 P03372 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HIF1A Q16665 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
SCHEMBL18012642 0.94 RAB9A (0.39) RAB9APDE4BPDE4DMAPK14PDK2
SCHEMBL17877624 0.86 KMT2A (0.40) RAB9APDE4BPDE4DMAPK14PDK2
SCHEMBL17877625 0.85 HPGD (0.39) RAB9APDE4BPDE4DMAPK14PDK2
SCHEMBL17953240 0.84 PDK2 (0.45) PDK2PKMMAPTCYP1A2CDK5
SCHEMBL18673351 0.83 ALK (0.36) RAB9APDE4BPDE4DMAPK14PDK2
SCHEMBL18012776 0.83 PKM (0.40) RAB9APDK2PKMMAPTKMT2A
SCHEMBL18012817 0.81 PDK2 (0.36) RAB9APDE4BPDE4DMAPK14PDK2
SCHEMBL18012785 0.81 PPARG (0.36) PKMMAPTKMT2AMEN1POLB
SCHEMBL18012814 0.81 MAPT (0.38) RAB9APDK2PKMMAPTKMT2A
SCHEMBL18012710 0.80 MAPT (0.53) RAB9APKMMAPTNPY1RNPY2R

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
Send feedback