SCHEMBL8630077

SCHEMBL8630077

C=CCOP(=O)(OCC=C)OOCC

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL8746827 0.80 TSHR (0.62) TSHRTP53TDP1
SCHEMBL709420 0.80 TSHR (0.62) TSHRTP53TDP1
SCHEMBL1415000 0.80 BTN3A1 (0.35) TSHR
Potassium Ion SCHEMBL9278240 0.79
Butane SCHEMBL28193264 0.78 TSHR (0.43) TSHRTDP1
SCHEMBL30605 0.77 TSHR (0.38) TSHR
SCHEMBL4812376 0.75 TSHR (0.48) TSHRTP53TDP1
SCHEMBL121928 0.74 TSHR (0.47) TSHRTP53TDP1
SCHEMBL2557778 0.73 TSHR (0.33) TSHR
SCHEMBL2589130 0.73 TSHR (0.33) TSHR

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
US-11882836-B2 1-amino-1-cyclopropanecarboxylic acid mixtures and uses thereof VALENT BIOSCIENCES LLC (US) 2024-01-30 US disclosed
US-11317626-B2 Forchlorfenuron mixtures and uses thereof VALENT BIOSCIENCES LLC (US) 2022-05-03 US disclosed
US-20210400978-A1 1-AMINO-1-CYCLOPROPANECARBOXYLIC ACID MIXTURES AND USES THEREOF VALENT BIOSCIENCES LLC (US) 2021-12-30 US disclosed
EP-3755679-A1 FORCHLORFENURON MIXTURES AND USES THEREOF Valent BioSciences LLC (US) 2020-12-30 EP disclosed
WO-2019165172-A1 FORCHLORFENURON MIXTURES AND USES THEREOF VALENT BIOSCIENCES LLC (US) 2019-08-29 WO disclosed
US-20190261629-A1 FORCHLORFENURON MIXTURES AND USES THEREOF VALENT BIOSCIENCES LLC 2019-08-29 US disclosed
US-9561160-B2 Oral care composition and processes for preparing same COLGATE-PALMOLIVE COMPANY (US) 2017-02-07 US disclosed
US-20160038385-A1 Oral Care Composition and Processes for Preparing Same COLGATE-PALMOLIVE COMPANY (US) 2016-02-11 US disclosed
WO-2014143017-A1 ORAL CARE COMPOSITION AND PROCESSES FOR PREPARING SAME COLGATE-PALMOLIVE COMPANY (US) 2014-09-18 WO disclosed
US-20120288547-A1 STABILIZATION OF ZINC OXIDE FILM IN ORAL COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2012-11-15 US disclosed
US-5833956-A Oral composition containing an anionic, a nonionic and an amphoteric surfactant system COLGATE-PALMOLIVE COMPANY (US) 1998-11-10 US 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 (5 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-20120288547-A1 STABILIZATION OF ZINC OXIDE FILM IN ORAL COMPOSITIONS SLC39A7, SOD1, SLC30A7 TSHR 3727/4885TP53 1372/4885TDP1 2258/4885
US-11882836-B2 1-amino-1-cyclopropanecarboxylic acid mixtures and uses thereof BMP1, ACACA, AHCY TSHR 4621/4885TP53 4744/4885TDP1 1741/4885
US-20210400978-A1 1-AMINO-1-CYCLOPROPANECARBOXYLIC ACID MIXTURES AND USES THEREOF ACACA, PCCA, MCCC2 TSHR 4752/4885TP53 4652/4885TDP1 2312/4885
US-20190261629-A1 FORCHLORFENURON MIXTURES AND USES THEREOF BROX, CNPY3, CNPY2 TSHR 3354/4885TP53 4730/4885TDP1 2721/4885
US-11317626-B2 Forchlorfenuron mixtures and uses thereof BROX, CNPY3, CNPY2 TSHR 3354/4885TP53 4730/4885TDP1 2721/4885

“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.