SCHEMBL28619936

SCHEMBL28619936

CC(NC(=O)C1CCN(C(=O)COc2ccc(Cl)cc2)CC1)c1ccc(Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
HPGD P15428 3/20 0.59
GAA P10253 1/20 0.59
ATF4 P18848 1/20 0.57
LMNA P02545 1/20 0.57
MAPT P10636 2/20 0.54
POLB P06746 2/20 0.54
RAB9A P51151 1/20 0.54
ACACB O00763 6/20 0.54
FKBP1A P62942 1/20 0.52
EPHX2 P34913 1/20 0.52
ACACA Q13085 1/20 0.51
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PRLHR P49683 2/20 0.49

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
SCHEMBL20989201 0.85 SMN1; SMN2 (0.53) SMN1; SMN2L3MBTL1GAALMNAMAPT
SCHEMBL19705237 0.79 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1HPGDGAAATF4
SCHEMBL4533467 0.79 POLB (0.76) SMN1; SMN2L3MBTL1HPGDATF4LMNA
SCHEMBL19692581 0.77 POLB (0.66) SMN1; SMN2L3MBTL1HPGDATF4LMNA
SCHEMBL12067608 0.76 ALDH1A1 (0.72) SMN1; SMN2L3MBTL1HPGDGAAATF4
SCHEMBL3918153 0.75 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1HPGDGAAATF4
SCHEMBL29532316 0.75 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1HPGDGAAATF4
SCHEMBL3918149 0.75 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1HPGDGAAATF4
SCHEMBL27979662 0.75 POLB (0.84) SMN1; SMN2L3MBTL1HPGDGAAATF4
SCHEMBL20989310 0.74 L3MBTL1 (0.50) SMN1; SMN2L3MBTL1GAAMAPTACACB

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
CN-109563071-B Chemical compounds as inhibitors of the ATF4pathway 葛兰素史密斯克莱知识产权发展有限公司 2021-08-03 CN claimed
CN-109563071-B Chemical compounds as inhibitors of the ATF4pathway 葛兰素史密斯克莱知识产权发展有限公司 2021-08-03 CN disclosed