SCHEMBL28755810

SCHEMBL28755810

NC(=O)OC1(c2ccc(Cl)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.41
▸ HSD11B1 P28845 6/20 0.40
▸ DRD2 P14416 13/20 0.39
▸ DRD4 P21917 12/20 0.39
▸ DRD3 P35462 12/20 0.39

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
SCHEMBL3812202 0.93 HSD11B1 (0.43) HDAC4HSD11B1DRD2DRD4DRD3
SCHEMBL7490230 0.83 HDAC4 (0.42) HDAC4HSD11B1DRD2DRD4DRD3
SCHEMBL28658382 0.81 TPMT (0.33) —
SCHEMBL2720401 0.81 CA1 (0.37) —
SCHEMBL28108261 0.81 CA1 (0.36) —
SCHEMBL7176061 0.81 DRD2 (0.52) HDAC4HSD11B1DRD2DRD4DRD3
SCHEMBL2572169 0.81 AKR1C1 (0.42) HDAC4HSD11B1DRD3
SCHEMBL28649793 0.80 PARP1 (0.43) HSD11B1
SCHEMBL6036780 0.76 HDAC4 (0.47) HDAC4HSD11B1DRD2DRD4DRD3
SCHEMBL17698403 0.76 ALDH1A1 (0.41) —

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
CN-114585603-A Prostaglandin EP4Receptor antagonist compounds 赫普泰雅治疗有限公司 2022-06-03 — — CN disclosed
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