SCHEMBL23748642

SCHEMBL23748642

CC(C)(C)c1cc(OCCC(=O)OCC(COC(=O)CCOc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)(COC(=O)CCOc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)COC(=O)CCOc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
VCAM1 P19320 9/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
BLM P54132 1/20 0.41
ATM Q13315 1/20 0.41
HIF1A Q16665 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 4/20 0.40
PKM P14618 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL31010734 0.99 CA1 (0.42) CA1CA2VCAM1KMT2AALDH1A1
SCHEMBL12216814 0.85 GAA (0.50) CA1CA2VCAM1KMT2AALDH1A1
SCHEMBL9700077 0.82 CA2 (0.52) CA1CA2VCAM1KMT2AALDH1A1
SCHEMBL30209 0.81 GAA (0.57) VCAM1KMT2AALDH1A1TSHRMEN1
SCHEMBL28560102 0.80 MCL1 (0.53) CA1CA2VCAM1KMT2AALDH1A1
SCHEMBL9467415 0.80 GAA (0.50) VCAM1KMT2AALDH1A1TSHRMEN1
SCHEMBL19663372 0.80 GAA (0.50) KMT2AALDH1A1TSHRMEN1USP2
SCHEMBL29923229 0.79 GAA (0.56) VCAM1KMT2AALDH1A1TSHRMEN1
SCHEMBL29764272 0.79 GAA (0.56) VCAM1KMT2AALDH1A1TSHRMEN1
SCHEMBL8862938 0.78 GAA (0.51) VCAM1KMT2AALDH1A1TSHRMEN1

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-112805331-B Pellets comprising a block copolymer and molded bodies obtained from the pellets 株式会社可乐丽 2023-06-09 CN disclosed
US-20210347931-A1 PELLETS INCLUDING BLOCK COPOLYMER AND SHAPED ARTICLES OBTAINED FROM SUCH PELLETS KURARAY CO., LTD. (JP) 2021-11-11 US disclosed
EP-3865541-A1 PELLETS CONTAINING BLOCK COPOLYMER AND MOLDED ARTICLE OBTAINED FROM SAID PELLETS Kuraray Co., Ltd. (JP) 2021-08-18 EP disclosed