SCHEMBL18626470

SCHEMBL18626470

CC(=O)N1CCC(C2C[C@@H](Cc3ccc(-c4ccccc4)cc3)N(C(=O)OC(C)(C)C)C2O)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.43
▸ JAK2 O60674 1/20 0.42
▸ JAK1 P23458 1/20 0.42
▸ USP30 Q70CQ3 2/20 0.41
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ STS P08842 1/20 0.38
▸ CETP P11597 1/20 0.38
▸ ACP1 P24666 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ PKM P14618 1/20 0.38

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
SCHEMBL10258235 0.81 CETP (0.44) GPR119USP30CETPKDM4E
SCHEMBL16941148 0.80 GPR119 (0.43) GPR119JAK2JAK1USP30PTPN2
SCHEMBL1909822 0.76 USP30 (0.43) GPR119USP30PTPN2PTPN1PTPN6
SCHEMBL18279997 0.75 KDM4E (0.59) GPR119USP30PTPN2PTPN1PTPN6
SCHEMBL19605627 0.71 KLK7 (0.45) USP30STSCETP
SCHEMBL20374862 0.71 NR1H2 (0.46) USP30
SCHEMBL18724921 0.71 KLK7 (0.45) USP30STSCETP
SCHEMBL19605628 0.71 KLK7 (0.45) USP30STSCETP
SCHEMBL9963887 0.71 KLK7 (0.45) USP30STSCETP
SCHEMBL18800923 0.70 CETP (0.40) GPR119USP30CETP

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
US-9593110-B2 Neprilysin inhibitors Theravence Biopharma R&D IP, LLC (US) 2017-03-14 — — US disclosed
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