SCHEMBL29472178

SCHEMBL29472178

CCC(C)(C)c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.51
NPC1 O15118 4/20 0.51
ATM Q13315 3/20 0.51
MAPK1 P28482 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 1/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
MAPT P10636 2/20 0.42
CYP2A6 P11509 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HBB P68871 1/20 0.39

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
SCHEMBL2489704 1.00 RAB9A (0.51) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL9160258 0.94 NPC1 (0.53) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL15457978 0.94 NPC1 (0.47) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL29445525 0.94 NPC1 (0.47) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL29445524 0.94 NPC1 (0.47) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL19010378 0.89 NPC1 (0.50) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL19689000 0.87 MAPK1 (0.48) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL11377033 0.85 CNR2 (0.38) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL20408452 0.85 NPC1 (0.41) RAB9ANPC1ATMMAPK1SMN1; SMN2
SCHEMBL20408454 0.83 ESR1 (0.42) RAB9ANPC1ATMMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116135830-B Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2024-10-18 CN claimed
CN-116135830-A Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2023-05-19 CN claimed
CN-112973778-B Iron-zirconium bimetal supported catalyst and preparation method and application thereof 浙江大学 2022-03-22 CN claimed
CN-112973790-B Zirconium-based alkylation catalyst and preparation method and application thereof 浙江大学 2022-03-22 CN claimed
CN-119930389-A Preparation method and application of 2-alkylanthracene 中国石油化工股份有限公司 2025-05-06 CN disclosed
CN-118955265-A Application of bipyridine catalyst in preparation of 2-alkylanthraquinone by oxidation of oxygen-containing gas 浙江恒逸石化研究院有限公司 2024-11-15 CN disclosed
CN-116135830-B Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2024-10-18 CN disclosed
CN-116135830-B Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2024-10-18 CN disclosed
CN-118771955-A Preparation method of 2-alkylanthracene and 2-alkylanthraquinone 中国石油化工股份有限公司 2024-10-15 CN disclosed
CN-118619805-A Method for efficiently purifying 2-alkylanthracene in anthracene alkylation product 杭州澜通科技有限公司 2024-09-10 CN disclosed
CN-114950554-B Catalyst for preparing 2-alkylanthraquinone by oxygen-containing gas oxidation and application thereof 浙江恒逸石化研究院有限公司 2024-08-13 CN disclosed
CN-118026832-A Method for preparing halogenated anthraquinone compounds in one step 浙江恒逸石化研究院有限公司 2024-05-14 CN disclosed
CN-113457723-B Ruthenium-zirconium composite alkylation catalyst and preparation method thereof 浙江大学衢州研究院 2023-12-08 CN disclosed
CN-116135830-A Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2023-05-19 CN disclosed
CN-116135830-A Synthesis method of 2-tertiary amyl anthraquinone 中国石油化工股份有限公司 2023-05-19 CN disclosed
CN-111484402-B Anthraquinone and its hydrocarbon derivative preparation method 浙江恒逸石化研究院有限公司 2023-05-02 CN disclosed
CN-114950554-A Catalyst for preparing 2-alkyl anthraquinone by oxidizing oxygen-containing gas and application thereof 浙江恒逸石化研究院有限公司 2022-08-30 CN disclosed
CN-112973778-B Iron-zirconium bimetal supported catalyst and preparation method and application thereof 浙江大学 2022-03-22 CN disclosed
CN-112973790-B Zirconium-based alkylation catalyst and preparation method and application thereof 浙江大学 2022-03-22 CN disclosed