SCHEMBL25435569

SCHEMBL25435569

C=C1CCC2C(C)(C)CCCC2(C)C1COC=O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PNLIP P16233 6/20 0.58
▸ PTPN1 P18031 3/20 0.56
▸ PTPN2 P17706 2/20 0.56
▸ RPS6KA5 O75582 3/20 0.45
▸ MAPKAPK2 P49137 3/20 0.45
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ LMNA P02545 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CYP19A1 P11511 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
SCHEMBL25395046 1.00 PNLIP (0.58) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL30585231 1.00 PNLIP (0.58) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL25397921 1.00 PNLIP (0.58) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL30585216 0.85 PNLIP (0.45) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL31592749 0.85 PNLIP (0.45) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL25396431 0.85 PNLIP (0.45) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL25395509 0.85 PNLIP (0.45) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL9864022 0.82 PNLIP (0.72) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL16259431 0.82 PNLIP (0.72) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2
SCHEMBL30515438 0.82 PNLIP (0.72) PNLIPPTPN1PTPN2RPS6KA5MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4479369-A1 PROCESS FOR PREPARING OCTAHYDRO-2(1H)-NAPHTHALENONE DERIVATIVES Firmenich SA (CH) 2024-12-25 — — EP disclosed
WO-2023156429-A1 PROCESS FOR PREPARING OCTAHYDRO-2(1H)-NAPHTHALENONE DERIVATIVES FIRMENICH SA (CH) 2023-08-24 — — WO disclosed
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