SCHEMBL7527503

SCHEMBL7527503

C=C(C)C(=O)OC=C(CC)OC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 3/20 0.34

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
SCHEMBL9186105 0.89 ALDH1A1 (0.38) ALDH1A1THRBTSHR
SCHEMBL9186107 0.89 ALDH1A1 (0.38) ALDH1A1THRBTSHR
SCHEMBL153165 0.80 FFAR3 (0.35)
SCHEMBL16661384 0.79 ALDH1A1 (0.39) ALDH1A1THRBTSHR
SCHEMBL5981417 0.79 ALDH1A1 (0.39) ALDH1A1THRBTSHR
SCHEMBL28054180 0.76 ALDH1A1 (0.41) ALDH1A1THRBTSHR
SCHEMBL722225 0.75
SCHEMBL28193257 0.73 ALDH1A1 (0.50) ALDH1A1THRBTSHR
Methacrylic Acid SCHEMBL28149528 0.71 ALDH1A1 (0.48) ALDH1A1THRBTSHR
SCHEMBL3516867 0.71 ALDH1A1 (0.48) ALDH1A1THRBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151740-A1 Synthesis of vinyl carbonates for use in producing vinyl carbamates ALLEN DAVID LEWIS (US) 2002-10-17 US disclosed
US-6423862-B1 REACTING HALOFORMIC ACID DERIVATIVE WITH ALKALI METAL FLUORIDE IN PRESENCE OF PHASE TRANSFER CATALYST; REACTING PRODUCT WITH VINYL SILOXANE COMPOUND TO FORM VINYL CARBONATE DERIVATIVE WRIGHT CHEMICAL CORPORATION 2002-07-23 US disclosed
US-20020058829-A1 SYNTHESIS OF VINYL CARBONATES FOR USE IN PRODUCING VINYL CARBAMATES ALLEN DAVID LEWIS (US) 2002-05-16 US disclosed
US-6362363-B1 REACTING HALOFORMIC ACID, ALKALI METAL FLUORIDE, A VINYLOXYSILANE, AND AN AMINE; PHASE TRANSFER AGENTS WRIGHT CHEMICAL CORPORATION 2002-03-26 US disclosed
US-6284911-B1 FLUORINATING A HALOFORMATE WITH A IA METAL FLUORIDE IN THE PRESENCE OF A PHASE TRANSFER CATALYST AND A SOLVENT; ESTERIFIFYING PRODUCT WITH A TRIHYDROCARBYL(VINYLOXY)SILANE WRIGHT CHEMICAL CORPORATION 2001-09-04 US disclosed
WO-2001000634-A1 SYNTHESIS OF VINYL CARBONATES FOR USE IN PRODUCING VINYL CARBAMATES WRIGHT CHEMICAL CORPORATION (US) 2001-01-04 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 (2 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-20020058829-A1 SYNTHESIS OF VINYL CARBONATES FOR USE IN PRODUCING VINYL CARBAMATES F12, F11, ME1 ALDH1A1 3994/4885THRB 2644/4885TSHR 1970/4885
US-20020151740-A1 Synthesis of vinyl carbonates for use in producing vinyl carbamates F12, F11, ME1 ALDH1A1 3994/4885THRB 2644/4885TSHR 1970/4885

“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.