SCHEMBL31160600

SCHEMBL31160600

CC(C)(C)OC(=O)N1CCC(COc2ccc(CCl)cc2C#N)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.49
CSF1R P07333 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
HDAC1 Q13547 1/20 0.42
SCN9A Q15858 1/20 0.42

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
SCHEMBL31160618 0.91 GPR119 (0.50) GPR119CSF1RKDM4EPKMHDAC1
SCHEMBL19834015 0.88 GPR119 (0.51) GPR119CSF1RKDM4EPKMSCN9A
SCHEMBL14771893 0.86 GPR119 (0.51) GPR119CSF1RKDM4EPKM
SCHEMBL31160553 0.84 GPR119 (0.45) GPR119CSF1RKDM4EPKM
SCHEMBL19833733 0.84 GPR119 (0.49) GPR119CSF1RKDM4EPKM
SCHEMBL31160608 0.83 GPR119 (0.49) GPR119KDM4EPKMHDAC1
SCHEMBL31160599 0.83 GPR119 (0.51) GPR119
SCHEMBL3250467 0.83 GPR119 (0.54) GPR119CSF1RKDM4EPKM
SCHEMBL17078840 0.81 GPR119 (0.55) GPR119KDM4EPKMHDAC1
SCHEMBL31160605 0.80 CHEK2 (0.46) GPR119HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024199421-A1 CYP11A1 INHIBITOR 山东轩竹医药科技有限公司 2024-10-03 WO disclosed