SCHEMBL9040301

SCHEMBL9040301

OCC1CCN2CCCCC12

nearest known ligand 0.84

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.84
▸ SLC18A3 Q16572 3/20 0.42
▸ CYP2D6 P10635 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ CHRM5 P08912 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ CHRM3 P20309 1/20 0.39

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
SCHEMBL23043270 0.93 TDP1 (0.80) TDP1SLC18A3CHRM4CHRM5CHRM1
SCHEMBL1856334 0.93 TDP1 (0.80) TDP1SLC18A3CHRM4CHRM5CHRM1
SCHEMBL9540610 0.93 TDP1 (0.80) TDP1SLC18A3CHRM4CHRM5CHRM1
SCHEMBL19317460 0.93 TDP1 (0.80) TDP1SLC18A3CHRM4CHRM5CHRM1
SCHEMBL29366521 0.93 TDP1 (0.80) TDP1SLC18A3CHRM4CHRM5CHRM1
Lupinine SCHEMBL914675 0.91 TDP1 (1.00) TDP1
Lupinine SCHEMBL177708 0.91 TDP1 (1.00) TDP1
Lupinine SCHEMBL2633852 0.91 TDP1 (1.00) TDP1
Lupinine SCHEMBL13593464 0.91 TDP1 (1.00) TDP1
SCHEMBL1871639 0.91 TDP1 (0.92) TDP1SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4205074-A Anti-spasmodic substituted quinolizidine and indolizidine compounds HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1980-05-27 — — US claimed
JP-55047681-A — — None — — JP disclosed
EP-0449294-B1 Hydroxymethyl-indolizidines and quinolizidines MERRELL PHARMA INC (US) 1996-07-10 — — EP disclosed
EP-0449294-A1 Hydroxymethyl-indolizidines and quinolizidines MERRELL PHARMACEUTICALS INC. (US) 1991-10-02 — — EP disclosed
US-5028614-A Hydroxymethyl-indolizidines and quinolizidines and their use as α-glucosidase I inhibitors MERRELL DOW PHARMACEUTICALS INC. (US) 1991-07-02 — — US disclosed
US-4205074-A Anti-spasmodic substituted quinolizidine and indolizidine compounds HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1980-05-27 — — US disclosed
JP-S5547681-A INDOLIZIDINE-METHANOL DERIVATIVE AND ITS PREPARATION HOKURIKU SEIYAKU CO LTD 1980-04-04 — — JP disclosed
EP-0004260-A1 Substituted quinolizidine and indolizidine-methanol derivatives, method for their preparation and medicaments containing them Hokuriku Pharmaceutical Co.,Ltd (JP) 1979-10-03 — — EP disclosed
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