SCHEMBL28847352

SCHEMBL28847352

Oc1ccccc1-c1cccc(Br)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 4/20 0.44
BCL2L1 Q07817 1/20 0.44
F7 P08709 1/20 0.42
CA2 P00918 4/20 0.42
LMNA P02545 3/20 0.42
ALOX15 P16050 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
CA1 P00915 3/20 0.42
EGFR P00533 2/20 0.42
FYN P06241 2/20 0.42
MMP9 P14780 2/20 0.42
RECQL P46063 2/20 0.42
ADAMTS4 O75173 1/20 0.42
MMP2 P08253 1/20 0.42
MMP8 P22894 1/20 0.42
CA6 P23280 1/20 0.42
CDK2 P24941 1/20 0.42
MMP12 P39900 1/20 0.42

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
SCHEMBL11323890 0.88 CA1 (0.45) ALDH1A1HPGDHSD17B10CA2LMNA
SCHEMBL2936933 0.83 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10BCL2L1CA2
SCHEMBL1697197 0.83 ALDH1A1 (0.55) ALDH1A1HPGDHSD17B10BCL2L1F7
SCHEMBL7112111 0.82 ALDH1A1 (0.44) ALDH1A1HPGDHSD17B10BCL2L1F7
SCHEMBL8158456 0.81 ALDH1A1 (0.48) ALDH1A1HPGDHSD17B10BCL2L1CA2
SCHEMBL79393 0.80 HPGD (0.58) ALDH1A1HPGDHSD17B10BCL2L1F7
SCHEMBL27741811 0.80 ALDH1A1 (0.43) ALDH1A1HPGDHSD17B10BCL2L1CA2
SCHEMBL17241785 0.78 MAPT (0.39) ALDH1A1HPGDCA2LMNACA1
SCHEMBL19656484 0.78 HSD11B1 (0.43) ALDH1A1HPGDCA2LMNACA1
SCHEMBL18871176 0.78 SMN1; SMN2 (0.42) ALDH1A1HPGDHSD17B10BCL2L1F7

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
CN-104053663-B Process for purifying organodiphosphite compounds 巴斯夫欧洲公司 2017-07-04 CN claimed
CN-104053663-B Process for purifying organodiphosphite compounds 巴斯夫欧洲公司 2017-07-04 CN disclosed