SCHEMBL8370932

SCHEMBL8370932

CC(C)Oc1cc(OC(C)C)cc(OC(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ALDH1A3 P47895 1/20 0.44
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
KMT2A Q03164 2/20 0.42
PARP10 Q53GL7 1/20 0.41
BRD4 O60885 1/20 0.40
BRPF1 P55201 1/20 0.40
POLB P06746 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4D Q08499 1/20 0.38
F2 P00734 1/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37

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
SCHEMBL25565735 0.91 PDE4A (0.42) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL8284844 0.88 FFAR4 (0.42) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL23458208 0.88 ALDH1A1 (0.61) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL18800170 0.88 ALDH1A1 (0.61) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL2154535 0.86 GRIN2D (0.41) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL387559 0.86 ALDH1A1 (0.38) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL25084178 0.86 ALDH1A1 (0.38) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL389494 0.86 ALDH1A1 (0.38) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL21202092 0.86 ALDH1A1 (0.38) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1
SCHEMBL5233624 0.86 ALDH1A1 (0.42) ALDH1A1ALDH1A3GRIN2DGRIN3BGRIN1

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
US-20170282170-A9 PHOSPHORUS-CONTAINING CATALYSTS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-10-05 US disclosed
US-9642249-B2 Resin composition, prepreg, and substrate employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-05-02 US disclosed
US-9642249-B2 Resin composition, prepreg, and substrate employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-05-02 US disclosed
US-20160214930-A1 CHEMICAL COMPOUNDS RESMAN AS (NO) 2016-07-28 US disclosed
US-20160207034-A1 PHOSPHORUS-CONTAINING CATALYSTS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-07-21 US disclosed
US-9012572-B2 Polyphenylene ether oligomer and article employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-04-21 US disclosed
US-20150094240-A1 CHEMICAL COMPOUNDS RESMAN AS (NO) 2015-04-02 US disclosed
US-20140323666-A1 POLYPHENYLENE ETHER OLIGOMER AND ARTICLE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2014-10-30 US disclosed
US-20140322545-A1 RESIN COMPOSITION, PREPREG, AND SUBSTRATE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2014-10-30 US disclosed
EP-0675410-B1 Resist composition for deep ultraviolet light WAKO PURE CHEM IND LTD (JP) 1999-08-04 EP disclosed
US-5780206-A USING AN ANTHRACENE DERIVATIVE AS AN ABSORBER ON HIGHLY REFLECTIVE SURFACES; ALKALI-SOLUBLE POLYMERS; GENERATION OF ACID CATALYSTS; FINE PATTERNS WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1998-07-14 US disclosed
US-5695910-A RESIN BECOMES ALKALI SOLUBLE BY ELIMINATING PROTECTIVE GROUPS BY ACTION OF IN SITU GENERATED ACID WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-09 US disclosed
EP-0675410-A1 Resist composition for deep ultraviolet light WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1995-10-04 EP 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 (4 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-20160207034-A1 PHOSPHORUS-CONTAINING CATALYSTS AR, NR2C2, ORC3 ALDH1A1 3157/4885ALDH1A3 806/4885GRIN2D 767/4885
US-20160214930-A1 CHEMICAL COMPOUNDS PTGES, PTGIS, PTGFR ALDH1A1 1333/4885ALDH1A3 2187/4885GRIN2D 4692/4885
US-20170282170-A9 PHOSPHORUS-CONTAINING CATALYSTS AR, NR2C2, ORC3 ALDH1A1 3157/4885ALDH1A3 806/4885GRIN2D 767/4885
US-20150094240-A1 CHEMICAL COMPOUNDS PTGES, PTGIS, PTGFR ALDH1A1 1333/4885ALDH1A3 2187/4885GRIN2D 4692/4885

“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.