SCHEMBL21551965

SCHEMBL21551965

CCCCC1(CCCC)c2cc(CC(C)=NO)ccc2-c2ccc(Sc3ccccc3)c([N+](=O)[O-])c21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.35
▸ LMNA P02545 3/20 0.35
▸ HTT P42858 3/20 0.35
▸ NPSR1 Q6W5P4 3/20 0.35
▸ GPR55 Q9Y2T6 2/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 6/20 0.34
▸ HPGD P15428 1/20 0.33
▸ PDE7A Q13946 2/20 0.30
▸ PDE7B Q9NP56 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ USP47 Q96K76 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
SCHEMBL21551987 0.87 SMN1; SMN2 (0.37) SMN1; SMN2LMNAHTTNPSR1GPR55
SCHEMBL21560757 0.84 MAPT (0.40) SMN1; SMN2LMNAHTTNPSR1GPR55
SCHEMBL21551980 0.81 MAPT (0.41) SMN1; SMN2LMNAHTTNPSR1GPR55
SCHEMBL21560743 0.77 MAPT (0.36) SMN1; SMN2LMNAHTTNPSR1GPR55
SCHEMBL21551829 0.67 CYP26A1 (0.39) SMN1; SMN2LMNAHTTNPSR1MEN1
SCHEMBL21558082 0.65 SMN1; SMN2 (0.37) SMN1; SMN2LMNAHTTNPSR1GPR55
SCHEMBL27866696 0.62 SMN1; SMN2 (0.38) SMN1; SMN2LMNAHTTNPSR1GPR55
SCHEMBL21551955 0.62 LMNA (0.31) SMN1; SMN2LMNAHTTNPSR1GPR55
Alcohol SCHEMBL28110638 0.62 APEX1 (0.41) —
SCHEMBL18012752 0.61 ESPL1 (0.38) SMN1; SMN2LMNAHTTNPSR1GPR55

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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