SCHEMBL8074416

SCHEMBL8074416

CC(=O)/C=C/c1c(C)c(C)c2c(c1C)CC(C)(C)C2

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
GLA P06280 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
IAPP P10997 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
SCHEMBL8074415 1.00 MAPT (0.33) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL8074294 0.87
SCHEMBL8074291 0.87
SCHEMBL8067821 0.85 LMNA (0.30) MAPTLMNA
SCHEMBL8067818 0.85 LMNA (0.30) MAPTLMNA
SCHEMBL8058725 0.84 KDM4E (0.33) LMNA
SCHEMBL8058722 0.84 KDM4E (0.33) LMNA
SCHEMBL11965792 0.77 GLA (0.43) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL8877840 0.76 ALDH1A1 (0.31) MAPTMEN1ALDH1A1KMT2A
SCHEMBL8878352 0.76 PTGS1 (0.32) MAPTMEN1ALDH1A1KMT2A

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
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