SCHEMBL8845684

SCHEMBL8845684

CC1(O)CCCC(=O)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.31
CYP19A1 P11511 1/20 0.30
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
SCHEMBL12494003 0.85 PTPN1 (0.36) LMNACYP2C9
SCHEMBL9803825 0.81 POLB (0.31) POLBCYP19A1LMNACYP2C9
SCHEMBL931588 0.75 KDM4E (0.32)
SCHEMBL11819919 0.75
SCHEMBL18215492 0.74 GRIN2D (0.32) LMNA
SCHEMBL12194088 0.74
SCHEMBL9803821 0.71 POLB (0.31) POLBLMNACYP2C9
SCHEMBL8845680 0.71 POLB (0.31) POLBLMNACYP2C9
SCHEMBL4446710 0.69
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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9169686-A None JP disclosed
US-8759366-B2 Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME CORP. (US) 2014-06-24 US disclosed
US-8551984-B2 Aminopyrimidines as SYK inhibitors MERCK SHARP & DOHME CORP. (US) 2013-10-08 US 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