SCHEMBL10872647

SCHEMBL10872647

CC[N+](C)(CC)Cc1cc(C)ccc1-n1nnc2cccc(O)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.34
▸ PKM P14618 4/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ HTT P42858 3/20 0.34
▸ STAT3 P40763 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KCNMA1 Q12791 3/20 0.33
▸ RAB9A P51151 5/20 0.33
▸ NPC1 O15118 4/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ ALDH1A1 P00352 4/20 0.31
▸ TSHR P16473 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 1/20 0.31

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
Iodide SCHEMBL9627643 0.99 LMNA (0.34) LMNAPKMSMN1; SMN2HTTSTAT3
SCHEMBL10872651 0.73 KCNMA1 (0.46) SMN1; SMN2KCNMA1RAB9ANPC1GAA
Iodide SCHEMBL9627645 0.72 KCNMA1 (0.45) SMN1; SMN2KCNMA1RAB9ANPC1GAA
SCHEMBL8645601 0.62 KCNMA1 (0.67) LMNASMN1; SMN2NPSR1KCNMA1RAB9A
SCHEMBL890612 0.60 KCNMA1 (0.67) LMNAPKMSMN1; SMN2KCNMA1RAB9A
SCHEMBL29845601 0.60 KCNMA1 (0.67) LMNAPKMSMN1; SMN2KCNMA1RAB9A
SCHEMBL29839046 0.60 KCNMA1 (0.69) LMNASMN1; SMN2KCNMA1RAB9ANPC1
SCHEMBL8040200 0.60 SLC9A1 (0.48) NPSR1KCNMA1RAB9ANPC1GAA
SCHEMBL3413666 0.59 TDP1 (0.47) LMNASMN1; SMN2HTTKCNMA1HPGD
SCHEMBL10872653 0.58 BCHE (0.31) —

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
EP-0180992-A2 Stabilizer compositions for synthetic resins imparting improved light stability ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1986-05-14 — — EP disclosed
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