SCHEMBL9320134

SCHEMBL9320134

[CH2]/C=C/c1cccc(-c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.43
BAD Q92934 1/20 0.43
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
NFE2L2 Q16236 1/20 0.42
CYP19A1 P11511 1/20 0.42
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
PLAAT3 P53816 1/20 0.41
PLAAT5 Q96KN8 1/20 0.41
PLAAT2 Q9NWW9 1/20 0.41
PLAAT4 Q9UL19 1/20 0.41
CHEK1 O14757 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
ALDH1A1 P00352 2/20 0.39
PTGS2 P35354 1/20 0.39
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
RELA Q04206 1/20 0.38

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
SCHEMBL9320139 1.00 BCL2L1 (0.43) BCL2L1BADMAOAMAOBNFE2L2
SCHEMBL4816658 0.84 CHEK1 (0.49) CYP19A1CHEK1
SCHEMBL7535716 0.84 NFE2L2 (0.58) BCL2L1BADMAOAMAOBNFE2L2
SCHEMBL530889 0.84 NFE2L2 (0.58) BCL2L1BADMAOAMAOBNFE2L2
Bromide SCHEMBL27958666 0.82 NFE2L2 (0.56) BCL2L1BADMAOAMAOBNFE2L2
SCHEMBL9131419 0.80 MAOB (0.64) BCL2L1BADMAOAMAOBNFE2L2
SCHEMBL15573059 0.79 CA1 (0.54) BCL2L1MAOAMAOBNFE2L2CYP19A1
SCHEMBL7208741 0.79 MAOB (0.44) BCL2L1BADMAOAMAOBNFE2L2
SCHEMBL22781006 0.79 MAOB (0.44) BCL2L1BADMAOAMAOBNFE2L2
SCHEMBL4814582 0.79 ATM (0.45) CHEK1HDAC2HDAC8

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
EP-0464408-B1 Process for preparing star compounds SEKISUI CHEMICAL CO LTD (JP) 1994-01-12 EP disclosed
US-5102966-A Addition polymerization of unsaturated ethers using an unsaturated alkenyl polyether adduct as initiator and a cation-donating compound SEKISUI CHEMICAL CO., LTD. (JP) 1992-04-07 US disclosed
EP-0464408-A1 Process for preparing star compounds SEKISUI CHEMICAL CO., LTD. (JP) 1992-01-08 EP disclosed