SCHEMBL3961037

SCHEMBL3961037

O=COSC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 4/20 0.33
ADH1C P00326 3/20 0.33
ADH1B P00325 2/20 0.33
ADH4 P08319 2/20 0.33
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
MC4R P32245 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ADH7 P40394 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
SCHEMBL27275935 0.71
SCHEMBL29077791 0.71
SCHEMBL1611850 0.67
SCHEMBL2828422 0.67
SCHEMBL19932987 0.67
SCHEMBL11838886 0.67 ADH1A (0.42) ADH1AADH1CADH1BADH4ALDH1A1
SCHEMBL11841362 0.67 ADH1A (0.42) ADH1AADH1CADH1BADH4ALDH1A1
SCHEMBL3961034 0.67 ALDH1A1 (0.32) ALDH1A1
SCHEMBL11840925 0.63
SCHEMBL2830205 0.63

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
WO-2009038006-A1 RANDOM COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed
WO-2009038031-A1 BLOCK COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed