SCHEMBL22874137

SCHEMBL22874137

C=C1CCC2C(C)(C)CCC[C@]2(C)[C@H]1CCOC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 6/20 0.53
▸ PNLIP P16233 3/20 0.53
▸ PTPN2 P17706 2/20 0.53
▸ POLB P06746 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ RPS6KA5 O75582 2/20 0.45
▸ MAPKAPK2 P49137 2/20 0.45
▸ TAS2R31 P59538 1/20 0.45

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
SCHEMBL15874164 1.00 PTPN1 (0.53) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL15874161 1.00 PTPN1 (0.53) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL22874138 1.00 PTPN1 (0.53) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL15874513 0.88 PTPN1 (0.55) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL25431893 0.88 PTPN1 (0.55) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL25399107 0.88 PTPN1 (0.55) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL15874514 0.88 PTPN1 (0.55) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL25395422 0.88 PTPN1 (0.55) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL24264493 0.84 PTPN1 (0.56) PTPN1PNLIPPTPN2POLBMAPT
SCHEMBL13722523 0.84 PTPN1 (0.56) PTPN1PNLIPPTPN2POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183761-A1 BIOCATALYTIC METHOD FOR THE CONTROLLED DEGRADATION OF TERPENE COMPOUNDS FIRMENICH SA (CH) 2023-06-15 — — US disclosed
US-20230183761-A1 BIOCATALYTIC METHOD FOR THE CONTROLLED DEGRADATION OF TERPENE COMPOUNDS FIRMENICH SA (CH) 2023-06-15 — — US disclosed
WO-2021005097-A9 BIOCATALYTIC METHOD FOR THE CONTROLLED DEGRADATION OF TERPENE COMPOUNDS FIRMENICH SA (CH) 2022-02-24 — — WO disclosed
WO-2021005097-A1 BIOCATALYTIC METHOD FOR THE CONTROLLED DEGRADATION OF TERPENE COMPOUNDS FIRMENICH SA (CH) 2021-01-14 — — WO disclosed
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