SCHEMBL2736403

SCHEMBL2736403

CCC(C)(CC(C)(C)C(=O)Oc1cccc2c(O)cccc12)C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 13/20 0.42
▸ ESR2 Q92731 13/20 0.42
▸ KMT2A Q03164 6/20 0.42
▸ GAA P10253 6/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ JAK2 O60674 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ CDC25B P30305 2/20 0.32
▸ ELANE P08246 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ CA7 P43166 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
SCHEMBL92373 0.83 ESR1 (0.51) ESR1ESR2KMT2AGAAMEN1
SCHEMBL20274282 0.77 ESR1 (0.52) ESR1ESR2KMT2AGAAMEN1
SCHEMBL18671983 0.76 ESR1 (0.49) ESR1ESR2KMT2AGAAMEN1
SCHEMBL14220068 0.76 ESR1 (0.49) ESR1ESR2KMT2AGAAMEN1
SCHEMBL8737835 0.75 ESR1 (0.44) ESR1ESR2KMT2AGAAMEN1
SCHEMBL18785883 0.74 ESR1 (0.57) ESR1ESR2KMT2AGAAMEN1
SCHEMBL10064125 0.73 ESR1 (0.39) ESR1ESR2KMT2AGAAMEN1
SCHEMBL12021737 0.72 ALDH1A1 (0.41) ESR1ESR2KMT2AGAAMEN1
SCHEMBL11991240 0.72 ESR1 (0.51) ESR1ESR2KMT2AGAAMEN1
SCHEMBL15113865 0.72 ESR1 (0.39) ESR1ESR2KMT2AGAAMEN1

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-9146467-B2 Coating compositions MERCK PATENT GMBH (DE) 2015-09-29 — — US disclosed
US-20130236833-A1 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-09-12 — — US disclosed
US-8455176-B2 Coating composition AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-06-04 — — US disclosed
US-8088548-B2 Bottom antireflective coating compositions AZ ELECTRONIC MATERIALS USA CORP. (US) 2012-01-03 — — US disclosed
US-20100119972-A1 COATING COMPOSITION MERCK PATENT GMBH (DE) 2010-05-13 — — US disclosed
US-20090104559-A1 Bottom Antireflective Coating Compositions MERCK PATENT GMBH (DE) 2009-04-23 — — 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 (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-20090104559-A1 Bottom Antireflective Coating Compositions SDC2, S100A9, MYH9 ESR1 2135/4885ESR2 2409/4885KMT2A 1852/4885
US-20100119972-A1 COATING COMPOSITION S100A9, CAPG, C5 ESR1 2137/4885ESR2 1875/4885KMT2A 2809/4885

“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.

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