SCHEMBL8530634

SCHEMBL8530634

CCCCC1CCOC(=O)CC1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.67
TLR4 O00206 1/20 0.40
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL20488928 0.95 CYP1A2 (0.75) CYP1A2HTT
SCHEMBL363462 0.93 CYP1A2 (0.73) CYP1A2HTT
SCHEMBL29874518 0.93 CYP1A2 (0.73) CYP1A2HTT
SCHEMBL29143658 0.89 CYP1A2 (0.56) CYP1A2TLR4LMNATP53
SCHEMBL26629561 0.87 CYP1A2 (0.55) CYP1A2TLR4POLBHPGDLMNA
SCHEMBL29356910 0.85 CYP1A2 (0.89) CYP1A2POLBHPGD
SCHEMBL30996494 0.84 CYP1A2 (0.50) CYP1A2TLR4POLBHPGDNOS1
Propiolactone SCHEMBL29087104 0.84 CYP1A2 (0.61) CYP1A2TLR4POLBHPGDLMNA
SCHEMBL29051454 0.83 CYP1A2 (0.49) CYP1A2TLR4POLBHPGDLMNA
SCHEMBL4927326 0.81 CYP1A2 (0.50) CYP1A2LMNANOS1NOS2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720035-A1 LIPID COMPOUNDS, COMPOSITIONS, AND USES THEREOF LIBERATE BIO, INC. (US) 2026-04-08 EP disclosed
WO-2024249525-A1 LIPID COMPOUNDS, COMPOSITIONS, AND USES THEREOF LIBERATE BIO, INC. (US) 2024-12-05 WO disclosed
CN-115135693-B With improved biodegradation capable alkoxylated polyamines 巴斯夫股份公司 2024-08-27 CN disclosed
WO-2023214534-A1 AMINOPOLYESTER AND LIPID NANOPARTICLES 国立大学法人北海道大学 2023-11-09 WO disclosed
CN-115135693-A Alkoxylated polyamines with improved biodegradability 巴斯夫股份公司 2022-09-30 CN disclosed
EP-0517203-B1 Acid-dye resistant polyamide products and process for preparation BASF CORP (US) 1998-02-04 EP disclosed
US-5562871-A CHEMICALLY BLOCKING A PORTION OF AMINO END GROUPS IN SULPHONATED POLYMER BASF CORPORATION (US) 1996-10-08 US disclosed
US-5560973-A SULFONATED POLYMER BASF CORPORATION (US) 1996-10-01 US disclosed
US-5548037-A INCLUDING SULFONATED GROUPS AND AN AMINE END BLOCKER BASF CORPORATION (US) 1996-08-20 US disclosed
US-5545363-A SULFONATING, PIGMENTING, BLOCKING SULFONATED POLYAMIDE, FINALLY MELT SPINNING BASF CORPORATION (US) 1996-08-13 US disclosed
US-5340886-A Acylation with a sulfonate compound, coloring, blocking and amidation with an alkyl anhydride, alkylaryl anhydride or a lactones BASF CORPORATION (US) 1994-08-23 US disclosed