SCHEMBL18012811

SCHEMBL18012811

CCC(=O)c1ccc2c(c1)C(CC)(CC)c1cc(C(=O)CC)ccc1-2

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.44
▸ MAPT P10636 4/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ PDK2 Q15119 5/20 0.37
▸ RAB9A P51151 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ GAA P10253 1/20 0.35

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
SCHEMBL28358222 0.92 HSD17B3 (0.45) ATMMAPTSMN1; SMN2L3MBTL1HPGD
SCHEMBL30617326 0.92 PDK2 (0.44) ATMMAPTSMN1; SMN2L3MBTL1PDK2
SCHEMBL18012749 0.92 PDK2 (0.44) ATMMAPTSMN1; SMN2L3MBTL1PDK2
SCHEMBL21551833 0.91 MAPT (0.38) ATMMAPTSMN1; SMN2L3MBTL1HPGD
SCHEMBL18012830 0.87 HSD17B3 (0.50) ATMMAPTALDH1A1HTTMEN1
SCHEMBL21552335 0.84 HPGD (0.43) ATMMAPTSMN1; SMN2L3MBTL1HPGD
SCHEMBL18012639 0.84 NPC1 (0.52) MAPTL3MBTL1HTTKMT2APDK2
SCHEMBL31128645 0.84 POLB (0.47) MAPTL3MBTL1HPGDALDH1A1TSHR
SCHEMBL18012740 0.79 PDK2 (0.44) PDK2
SCHEMBL27584898 0.79 MAPT (0.37) ATMMAPTSMN1; SMN2L3MBTL1HPGD

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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