SCHEMBL13871469

SCHEMBL13871469

Oc1ccc2ccc(-c3c(O)ccc4ccc(Oc5ccc6ccc(Oc7ccc8ccc(O)c(-c9ccc%10ccc(O)cc%10c9)c8c7)cc6c5)cc34)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 5/20 0.47
▸ HSD17B2 P37059 5/20 0.47
▸ CYP1A2 P05177 4/20 0.47
▸ CYP3A4 P08684 4/20 0.47
▸ CYP2D6 P10635 4/20 0.47
▸ CYP2C9 P11712 4/20 0.47
▸ CYP2B6 P20813 4/20 0.47
▸ CYP2C19 P33261 4/20 0.47
▸ ESR2 Q92731 12/20 0.46
▸ ESR1 P03372 11/20 0.46
▸ ABL1 P00519 2/20 0.41
▸ ABCB1 P08183 2/20 0.41
▸ BCR P11274 2/20 0.41

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
SCHEMBL13871471 1.00 HSD17B1 (0.47) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL13871467 0.99 HSD17B1 (0.46) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL13871476 0.90 HSD17B1 (0.54) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL13871466 0.90 HSD17B1 (0.54) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL13871477 0.87 HSD17B1 (0.56) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL13871465 0.86 HSD17B1 (0.50) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6
SCHEMBL12054411 0.79 CYP1A2 (0.58) CYP1A2CYP3A4ESR2ESR1ABL1
SCHEMBL20356051 0.79 CYP1A2 (0.58) CYP1A2CYP3A4ESR2ESR1ABL1
SCHEMBL12054413 0.79 CYP1A2 (0.58) CYP1A2CYP3A4ESR2ESR1ABL1
SCHEMBL20169571 0.78 ALOX5 (0.50) HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9475761-B2 Method for producing cyanogen-halide, cyanate ester compound and method for producing the same, and resin composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-10-25 — — US disclosed
US-9475761-B2 Method for producing cyanogen-halide, cyanate ester compound and method for producing the same, and resin composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-10-25 — — US disclosed
US-20150299110-A1 METHOD FOR PRODUCING CYANOGEN-HALIDE, CYANATE ESTER COMPOUND AND METHOD FOR PRODUCING THE SAME, AND RESIN COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-10-22 — — US disclosed
US-20150299110-A1 METHOD FOR PRODUCING CYANOGEN-HALIDE, CYANATE ESTER COMPOUND AND METHOD FOR PRODUCING THE SAME, AND RESIN COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-10-22 — — US disclosed
WO-2014065422-A9 CYANOGEN-HALIDE PRODUCTION METHOD, CYANATE ESTER COMPOUND AND PRODUCTION METHOD THEREFOR, AND RESIN COMPOSITION 三菱瓦斯化学株式会社 (JP) 2014-07-10 — — WO disclosed
US-8729192-B2 Epoxy resin composition, cured article thereof, novel epoxy resin, novel phenol resin and semiconductor-encapsulating material DIC CORPORATION (JP) 2014-05-20 — — US disclosed
US-8729192-B2 Epoxy resin composition, cured article thereof, novel epoxy resin, novel phenol resin and semiconductor-encapsulating material DIC CORPORATION (JP) 2014-05-20 — — US disclosed
WO-2014065422-A1 CYANOGEN-HALIDE PRODUCTION METHOD, CYANATE ESTER COMPOUND AND PRODUCTION METHOD THEREFOR, AND RESIN COMPOSITION 三菱瓦斯化学株式会社 (JP) 2014-05-01 — — WO disclosed
US-20090099303-A1 EPOXY RESIN COMPOSITION, CURED ARTICLE THEREOF, NOVEL EPOXY RESIN, NOVEL PHENOL RESIN AND SEMICONDUCTOR-ENCAPSULATING MATERIAL DIC CORPORATION (JP) 2009-04-16 — — US disclosed
US-20090099303-A1 EPOXY RESIN COMPOSITION, CURED ARTICLE THEREOF, NOVEL EPOXY RESIN, NOVEL PHENOL RESIN AND SEMICONDUCTOR-ENCAPSULATING MATERIAL DIC CORPORATION (JP) 2009-04-16 — — US disclosed
US-20090088535-A1 METHOD OF PRODUCING PHENOL RESIN AND METHOD OF PRODUCING EPOXY RESIN DIC CORPORATION (JP) 2009-04-02 — — US disclosed
US-20090088535-A1 METHOD OF PRODUCING PHENOL RESIN AND METHOD OF PRODUCING EPOXY RESIN DIC CORPORATION (JP) 2009-04-02 — — 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 (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-20150299110-A1 METHOD FOR PRODUCING CYANOGEN-HALIDE, CYANATE ESTER COMPOUND AND METHOD FOR PRODUCING THE SAME, AND RESIN COMPOSITION MB, CBR3, CRYAA HSD17B1 3627/4885HSD17B2 3682/4885CYP1A2 1055/4885

“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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