SCHEMBL8058627

SCHEMBL8058627

CCON=C(CC)C1=C(O)CC(c2c(C)c(C)c3c(c2Cl)CC(C)(CC)C3)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.30
HTT P42858 2/20 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
SCHEMBL8058622 1.00 RAB9A (0.38) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8069898 0.93 RAB9A (0.38) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8069894 0.93 RAB9A (0.38) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8072385 0.85 MEN1 (0.38) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8072382 0.85 MEN1 (0.38) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8069011 0.84 MEN1 (0.39) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8069014 0.84 MEN1 (0.39) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8877970 0.83 RAB9A (0.36) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL8877979 0.83 RAB9A (0.36) RAB9AMAPTKDM4EGAAMEN1
SCHEMBL10680083 0.82 RAB9A (0.47) RAB9AMAPTKDM4EGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996006071-A1 NOVEL HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES AND THEIR PREPARATION PROCESS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-02-29 WO claimed
US-6096930-A PREPARATION OF 2-METHYLINDANECARBOXYALDEHYDES BY REACTING A MALONYL HALIDE WITH A BENZENE DERIVATIVE, REDUCTION OF THE FORMED INDANEDIONE, REACTION WITH DICHLOROMETHYL METHYL ETHER KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2000-08-01 US disclosed
WO-1996006071-A1 NOVEL HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES AND THEIR PREPARATION PROCESS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-02-29 WO disclosed