SCHEMBL27766879

SCHEMBL27766879

CCc1nn(CC)c(C(=O)Cl)c1Br

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 1/20 0.33
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL6820020 0.86 NPC1 (0.44) KDM4EALOX15MAPTNPC1PTGDR2
SCHEMBL27727527 0.84 KDM4E (0.34) KDM4E
SCHEMBL28780937 0.84 KDM4E (0.34) KDM4ENPC1
SCHEMBL3049322 0.81 KDM4E (0.53) KDM4EMAPTALDH1A1
SCHEMBL27533617 0.81 LMNA (0.35) KDM4EMAPTNPC1ALDH1A1
SCHEMBL28784513 0.81 ALOX15 (0.33) KDM4EALOX15MAPTNPC1PTGDR2
SCHEMBL27767105 0.77 KDM4E (0.36) KDM4ENPC1
SCHEMBL27766774 0.74 ALDH1A1 (0.43) MAPTNPC1ALDH1A1
SCHEMBL6819929 0.71 MAPT (0.39) KDM4EALOX15MAPTNPC1ALDH1A1
SCHEMBL27727536 0.69 RAB9A (0.36) KDM4EMAPTNPC1ALDH1A1

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
CN-101613318-A Dihalo-propylene compound and preparation method thereof, application JIANGSU PROVINCE PESTICIDE RES 2009-12-30 CN disclosed