SCHEMBL3262848

SCHEMBL3262848

C=CCC(CC)C(=O)OO

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.37
GRIK2 Q13002 2/20 0.37
CPA1 P15085 1/20 0.36
TSHR P16473 6/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
HPGD P15428 1/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL5508483 0.85 GRIK1 (0.38) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL15600133 0.83 CA1 (0.52) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL15114435 0.83 CPA1 (0.40) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL8862223 0.83 CA1 (0.52) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL27586525 0.82 TSHR (0.46) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL28952855 0.81 CA2 (0.46) GRIK1GRIK2TSHRCA1CA2
SCHEMBL11392210 0.80 GRIK1 (0.35) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL28179739 0.80 TSHR (0.37) GRIK1GRIK2CPA1TSHRCA1
SCHEMBL247061 0.79
SCHEMBL29165359 0.79 CA2 (0.35) GRIK1GRIK2CPA1TSHRCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010016801-A1 MELT-STABLE AND HYDROLYSIS RESISTANT HYDROXY ACID POLYMER HYDROCHEM (S) PTE LTD (SG) 2010-02-11 WO claimed
EP-3350299-B1 CLEANING COMPOSITION AND METHOD OF CLEANING AIR INTAKE VALVE DEPOSITS Valvoline Licensing & Intellectual Property LLC (US) 2021-03-03 EP disclosed
US-10934508-B2 Alkyl hydroxybutyrate cleaning composition and method of cleaning air intake valve deposits VALVOLINE LICENSING AND INTELLECTUAL PROPERTY LLC (US) 2021-03-02 US disclosed
EP-3512929-A1 CLEANING COMPOSITION AND TESTING METHOD FOR AIR INTAKE VALVE DEPOSITS Valvoline Licensing and Intellectual Property LLC (US) 2019-07-24 EP disclosed
US-10077417-B2 Cleaning composition comprising an alkyl hydroxybutyrate and method of cleaning air intake valve deposits ASHLAND LICENSING AND INTELLECTUAL PROPERTY, LLC (US) 2018-09-18 US disclosed
EP-3350299-A1 CLEANING COMPOSITION AND METHOD OF CLEANING AIR INTAKE VALVE DEPOSITS Ashland Licensing and Intellectual Property LLC (US) 2018-07-25 EP disclosed
WO-2018052483-A1 CLEANING COMPOSITION AND TESTING METHOD FOR AIR INTAKE VALVE DEPOSITS ASHLAND LICENSING AND INTELLECTUAL PROPERTY, LLC (US) 2018-03-22 WO disclosed
WO-2017048694-A1 CLEANING COMPOSITION AND METHOD OF CLEANING AIR INTAKE VALVE DEPOSITS ASHLAND LICENSING AND INTELLECTUAL PROPERTY, LLC (US) 2017-03-23 WO disclosed
US-20170081621-A1 CLEANING COMPOSITION AND METHOD OF CLEANING AIR INTAKE VALVE DEPOSITS VGP IPCO LLC 2017-03-23 US disclosed