SCHEMBL18012800

SCHEMBL18012800

C/C(=N\OC(=O)C1CCCCC1)C(=O)c1ccc2c(c1)C(C)(C)c1cc(C(=O)/C(C)=N/OC(=O)C3CCCCC3)ccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ CASP3 P42574 1/20 0.46
▸ SENP8 Q96LD8 1/20 0.46
▸ SENP7 Q9BQF6 1/20 0.46
▸ SENP6 Q9GZR1 1/20 0.46
▸ ATM Q13315 1/20 0.45
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ RBBP9 O75884 1/20 0.40
▸ PKM P14618 1/20 0.38
▸ POLB P06746 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ PDK2 Q15119 3/20 0.37
▸ MIF P14174 2/20 0.36
▸ ELANE P08246 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ OPRM1 P35372 1/20 0.33

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
SCHEMBL18012815 0.88 RAB9A (0.45) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012778 0.86 ALDH1A1 (0.45) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012729 0.84 RAB9A (0.42) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012799 0.81 MAPT (0.40) RAB9ANPC1KMT2APKMPOLB
SCHEMBL18012806 0.79 RAB9A (0.38) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012711 0.78 RAB9A (0.44) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012648 0.76 ALDH1A1 (0.41) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012791 0.76 RAB9A (0.46) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18012798 0.76 KMT2A (0.47) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL18235835 0.76 PDK2 (0.41) KMT2APOLBL3MBTL1PDK2MAPT

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