SCHEMBL15004890

SCHEMBL15004890

C=C(C)CCOc1nc(OCCC(=C)C)nc(OCCC(=C)C)n1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ EPHX1 P07099 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
SCHEMBL11197621 0.76 CDK1 (0.37) HTTSMN1; SMN2CYP1A2L3MBTL1MAPK1
SCHEMBL2487338 0.75 CDK1 (0.39) HTTSMN1; SMN2POLBMAPK1HSD17B10
SCHEMBL11184649 0.74 CDK1 (0.36) HTTSMN1; SMN2CYP1A2L3MBTL1POLB
SCHEMBL11188636 0.74 CDK1 (0.36) HTTSMN1; SMN2CYP1A2L3MBTL1POLB
SCHEMBL11183310 0.74 HTT (0.35) HTTSMN1; SMN2CYP1A2L3MBTL1
Methacrylic Acid SCHEMBL12004216 0.69 HTT (0.38) HTTSMN1; SMN2CYP1A2L3MBTL1POLB
SCHEMBL2360555 0.69 THRB (0.53) HTTSMN1; SMN2CYP1A2L3MBTL1POLB
SCHEMBL4453201 0.68 RXRA (0.45) L3MBTL1
SCHEMBL662434 0.68 BTN3A1 (0.43) BTN3A1MAPK1HSD17B10EPHX1
SCHEMBL1835409 0.67 KCNA3 (0.54) SMN1; SMN2CYP1A2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9102663-B2 Method for producing epoxy compound having cyanuric acid skeleton NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-08-11 — — US disclosed
US-20130172525-A1 METHOD FOR PRODUCING EPOXY COMPOUND HAVING CYANURIC ACID SKELETON NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-04 — — US disclosed
EP-2602256-A1 METHOD FOR PRODUCING EPOXY COMPOUND HAVING CYANURIC ACID SKELETON Nissan Chemical Industries, Ltd. (JP) 2013-06-12 — — 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 (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-20130172525-A1 METHOD FOR PRODUCING EPOXY COMPOUND HAVING CYANURIC ACID SKELETON C9, EPX, C5 BTN3A1 2460/4885HTT 2194/4885SMN1; SMN2 2113/4885

“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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