SCHEMBL7705158

SCHEMBL7705158

C=CC(CCCC(=O)O)CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
NFKB1 P19838 2/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
BLM P54132 1/20 0.52
SLC6A3 Q01959 1/20 0.52
MEN1 O00255 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C19 P33261 1/20 0.52
KMT2A Q03164 1/20 0.52
ABCC4 O15439 1/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
ENPEP Q07075 2/20 0.41
GSTK1 Q9Y2Q3 2/20 0.41
PMP22 Q01453 1/20 0.40
TET2 Q6N021 3/20 0.38
KDM4A O75164 2/20 0.38
KDM4C Q9H3R0 2/20 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
SCHEMBL7705213 0.91 GSTK1 (0.50) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL11528893 0.91 CYP2D6 (0.60) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL21628120 0.87 ABCC4 (0.54) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL2935706 0.87 ABCC4 (0.54) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL6422160 0.87 ABCC4 (0.54) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL1733703 0.86 ALDH1A1 (0.46) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL28226428 0.83 FFAR4 (0.53) TSHRBLMMEN1CYP2D6CYP2C19
SCHEMBL7702223 0.80 SLC6A2 (0.54) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL12498852 0.80 LMNA (0.43) TSHRNFKB1SLC6A2SLC6A4BLM
SCHEMBL27906416 0.79 HDAC3 (0.46) TSHRNFKB1SLC6A2SLC6A4BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103038299-A Composition for use as coating material and adhesive, method for adhesive bonding, and laminated products RIKEN TECHNOS CORP 2013-04-10 CN disclosed
CN-102985497-A Coating for flooring materials and flooring material RIKEN TECHNOS CORP 2013-03-20 CN disclosed
CN-102906202-A Coating material for formation of hard coats, and molded products RIKEN TECHNOS CORP 2013-01-30 CN disclosed
CN-1813021-A Method for producing cycloolefin resin film or sheet JSR CORP (JP) 2006-08-02 CN disclosed
US-6348623-B2 (CO)POLYMERS OF 1-ACETOXY-2-METHOXY-3-BUTENE FOR EXAMPLE; CAN COPOLYMERIZE WITH VINYL ACETATE; REACTING ACETOACETOXY FUNCTIONAL POLYMER WITH AMMONIA OR PRIMARY OR SECONDARY AMINES TO FORM ENAMINE FUNCTIONAL POLYMERS; COATINGS EASTMAN CHEMICAL COMPANY 2002-02-19 US disclosed
US-20010051690-A1 Polymers of 3-butene esters, their preparation and use EASTMAN CHEMICAL COMPANY 2001-12-13 US disclosed
US-6228949-B1 ACETOACETOXY-DERIVATIZED HOMO OR CO-POLY(3,4-EPOXY-1-BUTENE) WHEREBY THE ACETOACETOXY GROUPS HAVE BEEN REACTED WITH AMMONIA, PRIMARY OR SECONDARY AMINE TO FORM ENAMINE FUNCTIONAL GROUPS; HIGH MOLECULAR WEIGHT COATINGS, ADHESIVES EASTMAN CHEMICAL COMPANY 2001-05-08 US disclosed
CN-1276800-A Polymers of 3-butenoic esters, process for their preparation and their use EASTMAN CHEMIAL CO (US) 2000-12-13 CN disclosed
US-6160057-A Polymers of 3-butene esters, their preparation and use EASTMAN CHEMICAL COMPANY (US) 2000-12-12 US disclosed
US-6121400-A FREE-RADICAL POLYMERIZATION PRODUCT; FOR COATING COMPOSITIONS SUCH AS INKS, ADHESIVES, PAINTS, AND FILMS EASTMAN CHEMICAL COMPANY (US) 2000-09-19 US disclosed
US-6121399-A Polymers of 3-butene esters, their preparation and use EASTMAN CHEMICAL COMPANY (US) 2000-09-19 US disclosed
EP-1023340-A1 POLYMERS OF 3-BUTENE ESTERS, THEIR PREPARATION AND USE EASTMAN CHEMICAL COMPANY (US) 2000-08-02 EP disclosed
WO-1999020666-A1 POLYMERS OF 3-BUTENE ESTERS, THEIR PREPARATION AND USE EASTMAN CHEMICAL COMPANY (US) 1999-04-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010051690-A1 Polymers of 3-butene esters, their preparation and use CCNT1, C1S, H1-3 TSHR 4644/4885NFKB1 3596/4885SLC6A2 3999/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.