SCHEMBL8845680

SCHEMBL8845680

CC1(C)CCCC(=O)[C@]1(C)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL9803821 0.81 POLB (0.31) POLBLMNACYP2C9
SCHEMBL11819919 0.75
SCHEMBL931588 0.75 KDM4E (0.32)
SCHEMBL8845684 0.71 POLB (0.31) POLBLMNACYP2C9
SCHEMBL9803825 0.71 POLB (0.31) POLBLMNACYP2C9
SCHEMBL7327673 0.71 FFAR3 (0.36) CYP2C9
SCHEMBL9018468 0.71 CTSK (0.34)
SCHEMBL4446710 0.69
SCHEMBL28796425 0.69 CRBN (0.36) LMNACYP2C9
SCHEMBL104614 0.69

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
JP-9169686-A None JP disclosed
JP-H09169686-A PRODUCTION OF PURE TRANS-AND CIS-4-HYDROXY-2,2,6-TRIMETHYLCYCLOHEXAN-1-ONE FROM ISOMERIC MIXTURE BASF AG 1997-06-30 JP disclosed