SCHEMBL24983170

SCHEMBL24983170

CC(C)(C)OC(=O)N1CCC2(CC=C(C3CC3)C2O)CC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ GPR119 Q8TDV5 9/20 0.41
▸ NAMPT P43490 5/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ ALDH1A1 P00352 1/20 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
SCHEMBL24033839 0.79 GPR119 (0.38) KDM4EMAPTTHRBGPR119NAMPT
SCHEMBL31186963 0.79 GPR119 (0.38) KDM4EMAPTTHRBGPR119NAMPT
SCHEMBL31186962 0.79 GPR119 (0.38) KDM4EMAPTTHRBGPR119NAMPT
SCHEMBL24982940 0.74 KDM4E (0.47) KDM4EMAPTTHRBGPR119PTPN2
SCHEMBL20618024 0.74 HPGD (0.46) KDM4EMAPTTHRBGPR119PTPN2
SCHEMBL29548956 0.74 HPGD (0.48) KDM4EMAPTTHRBGPR119NAMPT
SCHEMBL1344048 0.73 USP2 (0.50) GPR119NAMPTHPGD
SCHEMBL23901636 0.72 MAPT (0.45) KDM4EMAPTTHRBGPR119PTPN2
SCHEMBL20337418 0.72 USP2 (0.43) KDM4EMAPTTHRBGPR119NAMPT
SCHEMBL24703802 0.72 HPGD (0.43) KDM4EMAPTTHRBGPR119NAMPT

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
EP-4129987-A1 CRYSTAL FORM OF FREE ALKALI OF NITROGEN-CONTAINING AROMATIC DERIVATIVES Shanghai Hansoh Biomedical Co., Ltd. (CN) 2023-02-08 — — EP disclosed
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