SCHEMBL27901263

SCHEMBL27901263

CC(C)(C)c1ccc(OP(=O)(O)O)c(C(C)(C)C)c1.[KH]

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 11/20 0.44
INPP5A Q14642 6/20 0.44
AKT1 P31749 1/20 0.44
INPP5B P32019 2/20 0.44
APEX1 P27695 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
CYP2C19 P33261 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL431782 0.98 INPPL1 (0.46) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL30744579 0.98 INPPL1 (0.46) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL27864987 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL30643908 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL27910299 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
Ammonia Solution, Strong SCHEMBL27891990 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL28794879 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL6739019 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL21541942 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1
SCHEMBL27900451 0.97 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BAPEX1

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
CN-110088184-A Polybutylene terephthalate (PBT) composition for the product with high-dimensional stability SABIC环球技术有限责任公司 2019-08-02 CN disclosed
CN-102203140-B High melt flow propylene impact copolymer and method DOW GLOBAL TECHNOLOGIES INC (US) 2014-07-02 CN disclosed
CN-102827397-A Method for changing organic phosphate nucleating agent morphology and/or particle size, organic phosphate nucleating agent and application thereof, and polypropylene material CHINA PETROLEUM & CHEMICAL 2012-12-19 CN disclosed