SCHEMBL11295128

SCHEMBL11295128

CC(C)CCc1ccc(Oc2ccc(CCC(C)C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ AOC3 Q16853 1/20 0.44
▸ MMP12 P39900 1/20 0.42
▸ MMP13 P45452 1/20 0.42
▸ ACACB O00763 5/20 0.42
▸ ACACA Q13085 4/20 0.42
▸ FFAR1 O14842 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ST14 Q9Y5Y6 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL8294115 0.92 FFAR1 (0.53) MMP12MMP13FFAR1
SCHEMBL8080450 0.85 HTT (0.41) HTTSMN1; SMN2AOC3KDM4E
SCHEMBL879606 0.84 HTT (0.62) HTTSMN1; SMN2AOC3MEN1KMT2A
SCHEMBL3476568 0.84 FUT7 (0.46) AOC3MMP13L3MBTL1
SCHEMBL9906579 0.83 POLB (0.52) HTTSMN1; SMN2AOC3ACACBACACA
SCHEMBL7260186 0.82 THRA (0.46) HTTMMP12MMP13MEN1KMT2A
SCHEMBL24089506 0.81 TDP1 (0.63) HTTSMN1; SMN2MAPK1
SCHEMBL8293516 0.81 NQO1 (0.56) ACACBMAPTMAPK1
SCHEMBL11583143 0.81 HTT (0.42) HTTSMN1; SMN2MMP12MMP13ACACB
SCHEMBL7107805 0.79 ACACB (0.41) HTTSMN1; SMN2AOC3ACACBMEN1

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 8 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
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-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
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