SCHEMBL8072385

SCHEMBL8072385

C=CCON=C(CC)C1=C(O)CC(c2c(C)c(C)c3c(c2C)CC(C)(CC)C3)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL8072382 1.00 MEN1 (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL8071347 0.92 RAB9A (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL8071343 0.92 RAB9A (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL8058627 0.85 RAB9A (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL8058622 0.85 RAB9A (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL8069894 0.83 RAB9A (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL8069898 0.83 RAB9A (0.38) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL10796060 0.80 RAB9A (0.35) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL10796064 0.80 RAB9A (0.35) MEN1KMT2ARAB9AKDM4EGAA
SCHEMBL10683877 0.78 RAB9A (0.42) MEN1KMT2ARAB9AKDM4EGAA

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