SCHEMBL11205620

SCHEMBL11205620

O=C(O)C1(CCCc2cccc(Cl)c2)CO1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAAT3 P53816 1/20 0.46
PLAAT5 Q96KN8 1/20 0.46
PLAAT2 Q9NWW9 1/20 0.46
PLAAT4 Q9UL19 1/20 0.46
NAAA Q02083 2/20 0.45
TAAR1 Q96RJ0 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
HPGD P15428 1/20 0.44
GLA P06280 1/20 0.43
GRM2 Q14416 1/20 0.43
GRM3 Q14832 1/20 0.43
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
HTR3A P46098 1/20 0.43
HTR3D Q70Z44 1/20 0.43
HTR3C Q8WXA8 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL11202376 0.86 PLAAT3 (0.44) PLAAT3PLAAT5PLAAT2PLAAT4NAAA
SCHEMBL11209541 0.84 HDAC3 (0.47) SMN1; SMN2ALDH1A1LMNAHSD11B1
SCHEMBL11206802 0.82 MAPK1 (0.43) PLAAT3PLAAT5PLAAT2PLAAT4NAAA
SCHEMBL11259163 0.82 MAPT (0.57) NAAAALDH1A1KMT2AMEN1LMNA
SCHEMBL11205622 0.80 NAAA (0.45) PLAAT3PLAAT5PLAAT2PLAAT4NAAA
SCHEMBL11200671 0.80 HDAC1 (0.49) TAAR1KMT2AMEN1GRM2GRM3
SCHEMBL11203828 0.78 MAPT (0.50) NAAASMN1; SMN2
SCHEMBL6260288 0.77 KDM4E (0.51) ALDH1A1LMNATP53
Clomoxir SCHEMBL112980 0.77 ABCB11 (0.47) PLAAT3PLAAT5PLAAT2PLAAT4NAAA
SCHEMBL11270686 0.77 MAPT (0.49) NAAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0025192-B1 SUBSTITUTED OXIRANE CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICINES CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1983-05-11 EP claimed
US-4324796-A HYPOGLYCEMIC AGENTS, HYPOKETONEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-04-13 US claimed
EP-0025192-A2 Substituted oxirane carboxylic acids, process for their preparation, their use and medicines containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1981-03-18 EP claimed