SCHEMBL20004366

SCHEMBL20004366

CCOC(=O)CN(I)c1ccc(C(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
F10 P00742 1/20 0.38
OXTR P30559 1/20 0.38
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL20004346 0.83 LMNA (0.43) LMNAHTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL21199753 0.72 ALDH1A1 (0.50) LMNAHTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL20759997 0.72 MAPT (0.52) LMNAHTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL879019 0.70 CYP4F2 (0.68) LMNAHTTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL2624372 0.70 GAA (0.62) LMNAKDM4EALDH1A1KMT2AHPGD
SCHEMBL10745284 0.70 USP5 (0.51) LMNAHTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL9052677 0.70 MMP8 (0.53) LMNAHTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL8396219 0.69 SMN1; SMN2 (0.51) LMNAHTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL11827932 0.69 USP5 (0.63) LMNAHTTSMN1; SMN2ALDH1A1MEN1
Hydrochloric Acid SCHEMBL7951117 0.69 KDM4E (0.50) LMNAHTTSMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515912-B1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NAT RECH SCIENT (FR) 2020-10-14 EP disclosed
WO-2018055316-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-03-29 WO disclosed