SCHEMBL9693375

SCHEMBL9693375

FCC1=C2C=CC=CN2CC=C1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
KMT2A Q03164 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
SCHEMBL7450281 0.81 KDM4E (0.31) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL27574664 0.76 KDM4E (0.31) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL567392 0.75 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL30726103 0.75 CALM1 (0.33) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL28986086 0.75 KDM4E (0.33) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL27691106 0.74 KEAP1 (0.30)
SCHEMBL6850250 0.74
SCHEMBL27791467 0.72
SCHEMBL29104904 0.71 KDM4E (0.33) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL6423807 0.71 ALDH1A1 (0.33) KDM4EMEN1ALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992002560-A1 AMPHIPHILIC FLUORINE DERIVATIVES WITH TELOMERIC STRUCTURES; PREPARATION AND BIOMEDICAL APPLICATIONS S.A. A.T.T.A. APPLICATIONS ET TRANSFERTS DE TECHNO (FR) 1992-02-20 WO claimed