SCHEMBL8945018

SCHEMBL8945018

C=COC(CCC)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
ZDHHC7 Q9NXF8 1/20 0.38
TSHR P16473 5/20 0.34
HPGD P15428 1/20 0.33
ABCB1 P08183 1/20 0.33
CTSK P43235 1/20 0.33
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
TAS1R3 Q7RTX0 2/20 0.32
TAS1R1 Q7RTX1 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 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
SCHEMBL8944911 0.86 ZDHHC7 (0.53) CA1CA2ZDHHC7TSHRHPGD
SCHEMBL8945048 0.85 POLB (0.35) TSHRHPGDCHRM1AKR1A1CHRM3
SCHEMBL7772505 0.84 CA1 (0.38) CA1CA2ZDHHC7TSHRHPGD
SCHEMBL1565230 0.80 CHRM1 (0.43) CA2TSHRHPGDCHRM1AKR1A1
SCHEMBL4431247 0.77 CA1 (0.47) CA1CA2ZDHHC7TSHRABCB1
SCHEMBL8944923 0.77 ALDH1A1 (0.35) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL13955184 0.74 GRIK1 (0.32) MEN1KMT2A
SCHEMBL5793752 0.74 CA1 (0.44) CA1CA2ZDHHC7TSHRABCB1
SCHEMBL13715421 0.72 CA1 (0.42) CA1CA2ZDHHC7TSHRABCB1
SCHEMBL15111650 0.72 CA1 (0.42) CA1CA2ZDHHC7TSHRHPGD

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-2024068706-A1 POLYACID BASED BINDER AND THE USE THEREOF BASF SE (DE) 2024-04-04 WO disclosed
US-5520834-A VINYL ETHERS BASF AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed
US-5346974-A Hydrolyzed furan-maleic anhydride copolymer or terpolymer NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1994-09-13 US disclosed
US-5187238-A Copolymerizing furan, maleic anhydride, other unsaturated monomers, then oxidation or ozonolysis NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1993-02-16 US disclosed
EP-0359055-B1 DETERGENT COMPOSITIONS UTILIZING DIVINYL ETHER POLYMERS AS BUILDERS National Starch and Chemical Investment Holding Corporation (US) 1992-10-28 EP disclosed
US-5087682-A Oxidized polymer of furan and maleic anhydride NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-02-11 US disclosed
US-5061396-A OXIDIZED AND HYDROLYZED COPOLYMER OF FURAN AND MALEIC ANHYDRIDE NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1991-10-29 US disclosed
EP-0359055-A2 Detergent compositions utilizing divinyl ether polymers as builders National Starch and Chemical Investment Holding Corporation (US) 1990-03-21 EP disclosed
US-4906397-A Detergent compositions utilizing divinyl ether polymers as builders and novel divinyl ether polymers NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1990-03-06 US disclosed