SCHEMBL20178557

SCHEMBL20178557

CC(C)(C)c1ccc2c(c1)C([Hf](C)(C)C1C=CC=C1)c1cc(C(C)(C)C)ccc1-2

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
PLA2G1B P04054 1/20 0.34
NFKB1 P19838 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL21797756 0.83 ALDH1A1 (0.33) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL20972355 0.79 ALDH1A1 (0.46) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL21797775 0.75 RAB9A (0.34) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL21520224 0.72 GPR3 (0.38)
SCHEMBL9754016 0.71 ALDH1A1 (0.42) ALDH1A1NPC1PLA2G1BNFKB1CASP3
Hydrochloric Acid SCHEMBL21797750 0.71 ALDH1A1 (0.34) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL38651494 0.70 ALDH1A1 (0.36) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL1538379 0.69 ALDH1A1 (0.44) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL9754019 0.69 ALDH1A1 (0.44) ALDH1A1NPC1PLA2G1BNFKB1CASP3
SCHEMBL30719677 0.69 DYRK1A (0.52) 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3601384-B1 ALUMINOXANE-ACTIVATED METALLOCENE CATALYSTS BOREALIS AG (AT) 2023-05-03 EP disclosed
EP-3601385-B1 BORATE-ACTIVATED METALLOCENE CATALYSTS BOREALIS AG (AT) 2023-05-03 EP disclosed
US-11560440-B2 Aluminoxane-activated metallocene catalysts BOREALIS AG (AT) 2023-01-24 US disclosed
US-11248113-B2 Cyclic olefin copolymers and films prepared therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-02-15 US disclosed
US-11192963-B2 Borate-activated metallocene catalysts BOREALIS AG (AT) 2021-12-07 US disclosed
EP-3887447-A1 BLENDS OF CYCLIC OLEFIN COPOLYMERS AND FILMS PREPARED THEREFROM ExxonMobil Chemical Patents Inc. (US) 2021-10-06 EP disclosed
EP-3827033-A1 PREPARATION OF BIMODAL RUBBER, THERMOPLASTIC VULCANIZATES, AND ARTICLES MADE THEREFROM ExxonMobil Chemical Patents Inc. (US) 2021-06-02 EP disclosed
US-11008449-B2 Bimodal ethylene, alpha-olefin, and diene polymers using dual organometallic catalysts EXXONMOBIL CHEMICAL PATENTS INC. (US) 2021-05-18 US disclosed
US-20210108006-A1 BORATE-ACTIVATED METALLOCENE CATALYSTS BOREALIS AG (AT) 2021-04-15 US disclosed
US-20210095057-A1 ALUMINOXANE-ACTIVATED METALLOCENE CATALYSTS BOREALIS AG (AT) 2021-04-01 US disclosed
US-10730978-B2 Linear ethylene cyclic olefin polymers EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-08-04 US disclosed
US-20200172645-A1 Cyclic Olefin Copolymers and Films Prepared Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2020-06-04 US disclosed
WO-2020112551-A1 CYCLIC OLEFIN COPOLYMERS AND FILMS PREPARED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-06-04 WO disclosed
WO-2020112553-A1 BLENDS OF CYCLIC OLEFIN COPOLYMERS AND FILMS PREPARED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-06-04 WO disclosed
US-20200172715-A1 Blends of Cyclic Olefin Copolymers and Films Prepared Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2020-06-04 US disclosed
WO-2020023193-A1 PREPARATION OF BIMODAL RUBBER, THERMOPLASTIC VULCANIZATES, AND ARTICLES MADE THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-01-30 WO disclosed
US-20190144653-A1 Bimodal Ethylene, Alpha-Olefin, and Diene Polymers Using Dual Organometallic Catalysts EXXONMOBIL CHEMICAL PATENTS INC. 2019-05-16 US disclosed
US-9982081-B2 Cyclic olefin copolymers and methods of making them EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-05-29 US disclosed