SCHEMBL21677249

SCHEMBL21677249

CCOc1ccc([N+](=O)[O-])c(COC(=O)C(C)(C)CC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 1/20 0.50
▸ KMT2A Q03164 6/20 0.44
▸ MEN1 O00255 5/20 0.44
▸ RAB9A P51151 10/20 0.42
▸ NPC1 O15118 9/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ SMN1; SMN2 Q16637 7/20 0.42
▸ MAPK1 P28482 3/20 0.42
▸ PKM P14618 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ GAA P10253 2/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40

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
SCHEMBL21677327 0.89 MAPT (0.51) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL18972415 0.84 MAPT (0.56) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL22389455 0.78 MAPT (0.61) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL22291692 0.77 MAPT (0.69) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL5005582 0.76 MAPT (0.63) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL23177031 0.76 LMNA (0.51) MAPTALDH1A1LMNARAB9ANPC1
SCHEMBL14334021 0.76 MAPT (0.56) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL27060536 0.76 SNCA (0.41) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL16095591 0.75 MAPT (0.55) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL14568385 0.74 MEN1 (0.41) MAPTALDH1A1LMNAKMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11111331-B2 Block copolymer containing photo-sensitive moiety LG CHEM, LTD. 2021-09-07 — — US disclosed
US-20200040122-A1 Block Copolymer Containing Photo-sensitive Moiety LG CHEM, LTD. (KR) 2020-02-06 — — US disclosed
Send feedback