SCHEMBL28868288

SCHEMBL28868288

CC(C)(C)c1ccc2c(c1)[CH]c1cc(C(C)(C)C)ccc1-2.C[Hf]C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
NPC1 O15118 1/20 0.42
PLA2G1B P04054 1/20 0.42
NFKB1 P19838 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 2/20 0.36

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
SCHEMBL714735 0.93 ALDH1A1 (0.47) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL21631842 0.91 ALDH1A1 (0.45) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL21244337 0.91 ALDH1A1 (0.45) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL27727744 0.91 ALDH1A1 (0.45) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL27862672 0.91 ALDH1A1 (0.45) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL20538824 0.89 ALDH1A1 (0.41) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL22189167 0.85 ALDH1A1 (0.41) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL22471690 0.85 ALDH1A1 (0.41) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL27651373 0.85 ALDH1A1 (0.41) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL28204936 0.85 ALDH1A1 (0.46) ALDH1A1NPC1PLA2G1BNFKB1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114901490-B Functionalized polymer tread additives for improving winter tyre performance 埃克森美孚化学专利公司 2024-03-15 CN disclosed
CN-114829155-B Functionalized polymer tread additives for improving truck and bus radial tire performance 埃克森美孚化学专利公司 2024-03-05 CN disclosed
CN-117157333-A Ethylene copolymers with improved uniform molecular structure 博里利斯股份公司 2023-12-01 CN disclosed
CN-116917404-A bimodal polyethylene composition 诺瓦化学品(国际)股份有限公司 2023-10-20 CN disclosed
CN-112585178-B Polyethylene composition and film with good permeability, stiffness and sealability 诺瓦化学品(国际)股份有限公司 2023-06-20 CN disclosed
CN-112543775-B Polyethylene composition and film with maintained dart impact 诺瓦化学品(国际)股份有限公司 2023-06-16 CN disclosed
CN-109135034-A It can be used for the preparation method of the polymer composition of oil plant modifying agent 埃克森美孚化学专利公司 2019-01-04 CN disclosed