SCHEMBL21560757

SCHEMBL21560757

CCCCC1(CCCC)c2cc(C(=O)/C(C)=N/O)ccc2-c2ccc(Sc3ccccc3)c([N+](=O)[O-])c21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.40
▸ SMN1; SMN2 Q16637 5/20 0.37
▸ GAA P10253 1/20 0.35
▸ HTT P42858 5/20 0.35
▸ MEN1 O00255 5/20 0.33
▸ KMT2A Q03164 5/20 0.33
▸ LMNA P02545 3/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ USP47 Q96K76 1/20 0.32
▸ PDE7A Q13946 3/20 0.31
▸ POLB P06746 2/20 0.30
▸ BCL2L1 Q07817 1/20 0.30
▸ PDE7B Q9NP56 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
SCHEMBL21560743 0.89 MAPT (0.36) MAPTSMN1; SMN2GAAHTTMEN1
SCHEMBL21551980 0.87 MAPT (0.41) MAPTSMN1; SMN2GAAHTTMEN1
SCHEMBL21551965 0.84 SMN1; SMN2 (0.35) MAPTSMN1; SMN2GAAHTTMEN1
SCHEMBL21551987 0.81 SMN1; SMN2 (0.37) MAPTSMN1; SMN2GAAHTTMEN1
SCHEMBL18235864 0.76 PDK2 (0.41) MAPTSMN1; SMN2POLB
SCHEMBL21551828 0.73 HPGD (0.42) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL21551977 0.70 MAPT (0.38) MAPTSMN1; SMN2GAAHTTALDH1A1
SCHEMBL21551955 0.69 LMNA (0.31) SMN1; SMN2HTTKMT2ALMNANPSR1
SCHEMBL21551952 0.68 HPGD (0.44) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL18012644 0.67 MAPT (0.48) MAPTSMN1; SMN2HTTPOLB

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-2019216600-A1 NOVEL OXIME ESTER COMPOUND AND PHOTORESIST COMPOSITION COMPRISING SAME 주식회사 트리엘 (KR) 2019-11-14 — — WO disclosed
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