SCHEMBL8957418

SCHEMBL8957418

CC(C)CCc1ccccc1Oc1ccccc1CCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.44
TAAR1 Q96RJ0 1/20 0.42
AOC3 Q16853 1/20 0.42
SLC6A2 P23975 5/20 0.41
SLC6A4 P31645 5/20 0.41
SLC6A3 Q01959 4/20 0.41
HTR2A P28223 1/20 0.39
RIPK1 Q13546 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 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
SCHEMBL6685378 0.89 HRH1 (0.61) HRH1SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL7636733 0.86 TAAR1 (0.60) TAAR1AOC3SIGMAR1HTT
SCHEMBL31147801 0.86 TAAR1 (0.60) TAAR1AOC3SIGMAR1HTT
SCHEMBL6061359 0.85 MAP1LC3B (0.41)
SCHEMBL358608 0.85 ADRB2 (0.46) HRH1TAAR1AOC3SLC6A2SLC6A4
SCHEMBL5704525 0.85 ADRB2 (0.46) HRH1TAAR1AOC3SLC6A2SLC6A4
SCHEMBL9581086 0.84 HTT (0.42) HRH1TAAR1AOC3SLC6A2SLC6A4
SCHEMBL14130989 0.84 ADRA2A (0.42) TAAR1AOC3SLC6A2SLC6A4SLC6A3
SCHEMBL2211602 0.82 L3MBTL1 (0.53) SLC6A2SLC6A4SLC6A3HTR1APOLB
SCHEMBL11583138 0.82 HRH1 (0.41) HRH1TAAR1AOC3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116670108-A Ether compounds as volatiles for treating amino acid based substrates such as skin and hair 迈图高新材料有限责任公司 2023-08-29 CN claimed
EP-0299561-B1 Perfume and bleach compositions UNILEVER NV (NL) 1996-01-10 EP claimed
CN-118020932-A Application of Meinaria fruit leaf extract in reducing arecoline toxicity 华南农业大学 2024-05-14 CN disclosed
CN-116670108-A Ether compounds as volatiles for treating amino acid based substrates such as skin and hair 迈图高新材料有限责任公司 2023-08-29 CN disclosed
EP-0073662-B1 OLEFIN POLYMERIZATION CATALYST AMOCO CORPORATION (US) 1987-03-25 EP disclosed
US-4400494-A Olefin polymerization catalyst STANDARD OIL COMPANY (INDIANA) (US) 1983-08-23 US disclosed
EP-0073662-A2 Olefin polymerization catalyst AMOCO CORPORATION (US) 1983-03-09 EP disclosed
EP-0049996-A2 Olefin polymerization catalyst Standard Oil Company (US) 1982-04-21 EP disclosed
US-4324693-A COMPLEXING TITANIUM CHLORIDE-ALUMINUM ALKYL REACTION PRODUCT WITH MIXTURE OF DIBUTYL AND DIISOAMYL ETHERS STANDARD OIL COMPANY (INDIANA) 1982-04-13 US disclosed
US-4222893-A Process for forming high performance titanium trichloride olefin polymerization catalyst components STANDARD OIL COMPANY (INDIANA) (US) 1980-09-16 US disclosed
US-4111836-A PROCESS FOR FORMING HIGH PERFORMANCE TITANIUM TRICHLORIDE OLEFIN POLYMERIZATION CATALYST COMPONENTS STANDARD OIL COMPANY (INDIANA) (US) 1978-09-05 US disclosed
US-3984350-A Catalyst component comprising brown titanium trichloride STANDARD OIL COMPANY (INDIANA) (US) 1976-10-05 US disclosed