SCHEMBL11388564

SCHEMBL11388564

CN1[C@@H]2CC[C@H]1CC(C(=O)O)C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
CYP2C9 P11712 2/20 0.52
TDP1 Q9NUW8 2/20 0.48
HTR3E A5X5Y0 2/20 0.43
HTR3B O95264 2/20 0.43
HTR3A P46098 2/20 0.43
HTR3D Q70Z44 2/20 0.43
HTR3C Q8WXA8 2/20 0.43
CHRNA7 P36544 1/20 0.43
CHRM3 P20309 5/20 0.41
CHRM2 P08172 3/20 0.41
CHRM1 P11229 3/20 0.41
CHRM4 P08173 2/20 0.41
CHRM5 P08912 2/20 0.41
CYP2D6 P10635 2/20 0.40
HSD17B10 Q99714 1/20 0.40
BLM P54132 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 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
SCHEMBL8947045 1.00 LMNA (0.52) LMNACYP2C9TDP1HTR3EHTR3B
Hydrochloric Acid SCHEMBL2417970 0.98 TDP1 (0.52) LMNACYP2C9TDP1HTR3EHTR3B
SCHEMBL7662681 0.82 LMNA (0.48) LMNACYP2C9TDP1HTR3EHTR3B
SCHEMBL7662691 0.82 LMNA (0.48) LMNACYP2C9TDP1HTR3EHTR3B
SCHEMBL7662685 0.82 LMNA (0.48) LMNACYP2C9TDP1HTR3EHTR3B
SCHEMBL6648506 0.81 LMNA (0.52) LMNACYP2C9TDP1HTR3EHTR3B
SCHEMBL23475160 0.80 MAPT (0.40) LMNACYP2C9TDP1MEN1KMT2A
SCHEMBL26728043 0.80 MAPT (0.40) LMNACYP2C9TDP1MEN1KMT2A
SCHEMBL4128527 0.79 LMNA (0.50) LMNACYP2C9TDP1HTR3EHTR3B
SCHEMBL16891684 0.77 SMN1; SMN2 (0.39) LMNATDP1CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4281130-A Lower-alkyl 4,6,7,8,8a-9-hexahydro-6,9-ethanothieno[3,2-f]indolizine-10-carboxylate STERLING DRUG INC. (US) 1981-07-28 US disclosed
US-4233448-A 3-Methoxycarbonyl-2-(2-thienyl)-8-azabicyclo[3.2.1]octane-8-acetamide and salts thereof STERLING DRUG INC. (US) 1980-11-11 US disclosed
US-4233449-A 1-(8-Methyl-2-phenyl(or thienyl)-8-azabicyclo[3.2.1]octan-3-yl) ethanone STERLING DRUG INC. (US) 1980-11-11 US disclosed
US-4214084-A Ethanopyrrolo[1,2-b]isoquinolines STERLING DRUG INC. (US) 1980-07-22 US disclosed
US-4179567-A 2-Aryltropane compounds STERLING DRUG INC. (US) 1979-12-18 US disclosed