SCHEMBL29013154

SCHEMBL29013154

Cc1ccc(S(=O)(=O)OCCC2CCN(NC(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
RAB9A P51151 1/20 0.40
MMP13 P45452 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP2D6 P10635 1/20 0.38
ACACB O00763 1/20 0.37

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
SCHEMBL3119345 0.84 GPR119 (0.44) GPR119MEN1KMT2AMMP13
SCHEMBL3128149 0.84 ALDH1A1 (0.51) GPR119MEN1KMT2AKDM4EMMP13
SCHEMBL282240 0.84 GPR119 (0.60) GPR119MEN1KMT2AMMP13
SCHEMBL30965535 0.83 MEN1 (0.38) GPR119MEN1KMT2ARAB9AMMP13
SCHEMBL3119446 0.83 KMT2A (0.48) GPR119MEN1KMT2AMMP13
SCHEMBL3120252 0.83 KMT2A (0.48) GPR119MEN1KMT2AMMP13
SCHEMBL3119461 0.83 KMT2A (0.48) GPR119MEN1KMT2AMMP13
SCHEMBL28410550 0.83 DRD2 (0.47) KMT2AALDH1A1ACACB
SCHEMBL3116724 0.82 GPR119 (0.42) GPR119MEN1KMT2AMMP13
SCHEMBL30981046 0.82 MMP13 (0.44) GPR119MEN1KMT2ARAB9AMMP13

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
CN-116261458-B PLK1 degradation inducing compounds 厄普特拉株式会社 2024-05-24 CN disclosed
CN-116322700-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2023-06-23 CN disclosed
CN-116261458-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2023-06-13 CN disclosed