SCHEMBL20299554

SCHEMBL20299554

CC(C)(C)c1cc(Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2OP(=O)(O)O)c(OP(=O)(O)O)c(C(C)(C)C)c1.[KH]

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 6/20 0.35
INPP5A Q14642 5/20 0.34
SRC P12931 2/20 0.34
AKT1 P31749 1/20 0.33
NR5A2 O00482 1/20 0.33
NR5A1 Q13285 1/20 0.33
HMGCR P04035 1/20 0.33
CYP2C19 P33261 2/20 0.33
HSPA5 P11021 2/20 0.33
INPP5B P32019 2/20 0.32
CYP2C9 P11712 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HIF1A Q16665 1/20 0.32
RARG P13631 1/20 0.32
RXRA P19793 1/20 0.32
PPARG P37231 1/20 0.32
ELANE P08246 1/20 0.31
CD69 Q07108 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL2334329 0.98 INPPL1 (0.36) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL29612109 0.98 INPPL1 (0.36) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL1132177 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL35073 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL500875 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL20299525 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL20299533 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL888647 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
SCHEMBL9660044 0.97 INPPL1 (0.35) INPPL1INPP5ASRCAKT1NR5A2
Water SCHEMBL30183492 0.95 INPPL1 (0.34) INPPL1INPP5ASRCAKT1NR5A2

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
EP-3559102-A1 POLY(BUTYLENE TEREPHTHALATE) COMPOSITION FOR ARTICLES HAVING HIGH DIMENSIONAL STABILITY SABIC Global Technologies B.V. (NL) 2019-10-30 EP disclosed
WO-2018115293-A1 POLY(BUTYLENE TEREPHTHALATE) COMPOSITION FOR ARTICLES HAVING HIGH DIMENSIONAL STABILITY SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2018-06-28 WO disclosed