SCHEMBL3287701

SCHEMBL3287701

CC(C)(C)c1c(OP(=O)(O)O)ccc(-c2ccccc2)c1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
PDE3A Q14432 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GPR84 Q9NQS5 1/20 0.41
INPPL1 O15357 8/20 0.41
INPP5A Q14642 4/20 0.41
AKT1 P31749 1/20 0.41
INPP5B P32019 2/20 0.39
TSHR P16473 1/20 0.36
PTPN5 P54829 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL11111474 0.88 KDM4E (0.40) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL8596411 0.88 INPPL1 (0.46) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL3289172 0.87 INPPL1 (0.40) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL3289174 0.82 INPPL1 (0.39) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL2140496 0.79 ALDH1A1 (0.37) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL8594515 0.78 GPR84 (0.47) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL8426306 0.78 GPR84 (0.47) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL27698173 0.77 KDM4E (0.40) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL10534592 0.76 INPPL1 (0.48) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL29128772 0.76 ALDH1A1 (0.40) ALDH1A1HPGDHSD17B10AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723449-B2 Catalysts for synthesizing a polypropylene with a wide molecular weight distribution and use of the same CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2010-05-25 US claimed
US-20090023881-A1 Catalyst for synthesizing a polypropylene with a wide molecular weight distribution and use of the same CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2009-01-22 US claimed
US-7723449-B2 Catalysts for synthesizing a polypropylene with a wide molecular weight distribution and use of the same CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2010-05-25 US disclosed
US-20090023881-A1 Catalyst for synthesizing a polypropylene with a wide molecular weight distribution and use of the same CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2009-01-22 US disclosed