SCHEMBL21909574

SCHEMBL21909574

CC(C)/C=N/NC(=O)c1ccc(N)cc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.59
▸ GAA P10253 5/20 0.59
▸ KDM4E B2RXH2 3/20 0.59
▸ POLB P06746 2/20 0.59
▸ HTT P42858 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ ALDH1A1 P00352 5/20 0.49
▸ TDP1 Q9NUW8 1/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ ESR2 Q92731 1/20 0.46
▸ PTPN1 P18031 1/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ PIK3CG P48736 5/20 0.44
▸ KLKB1 P03952 1/20 0.44
▸ GPR39 O43194 1/20 0.42
▸ PHGDH O43175 1/20 0.40
▸ NCOA1 Q15788 1/20 0.40
▸ NCOA3 Q9Y6Q9 1/20 0.40

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
SCHEMBL21433613 1.00 MAPT (0.59) MAPTGAAKDM4EPOLBHTT
SCHEMBL21433614 1.00 MAPT (0.59) MAPTGAAKDM4EPOLBHTT
SCHEMBL21433615 0.78 GAA (0.50) MAPTGAAKDM4EPOLBHTT
SCHEMBL21433602 0.75 GAA (0.47) MAPTGAAKDM4EPOLBHTT
SCHEMBL21433603 0.75 GAA (0.47) MAPTGAAKDM4EPOLBHTT
SCHEMBL21433599 0.73 GAA (0.48) MAPTGAAKDM4EPOLBALDH1A1
SCHEMBL21433598 0.73 GAA (0.48) MAPTGAAKDM4EPOLBALDH1A1
SCHEMBL12216548 0.73 GAA (0.62) MAPTGAAKDM4EPOLBMEN1
SCHEMBL1555835 0.71 KDM4E (0.62) MAPTGAAKDM4EPOLBMEN1
SCHEMBL1264279 0.71 ALDH1A1 (0.69) MAPTGAAKDM4EPOLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339272-B2 Additive for rubber, rubber composition, and tire using the same BRIDGESTONE CORPORATION (JP) 2022-05-24 — — US disclosed
US-11339272-B2 Additive for rubber, rubber composition, and tire using the same BRIDGESTONE CORPORATION (JP) 2022-05-24 — — US disclosed
US-20210171744-A1 TIRE RUBBER COMPOSITION AND TIRE BRIDGESTONE CORPORATION (JP) 2021-06-10 — — US disclosed
US-20210108048-A1 ADDITIVE FOR RUBBER, RUBBER COMPOSITION, AND TIRE USING THE SAME BRIDGESTONE CORPORATION (JP) 2021-04-15 — — US disclosed
US-20210108048-A1 ADDITIVE FOR RUBBER, RUBBER COMPOSITION, AND TIRE USING THE SAME BRIDGESTONE CORPORATION (JP) 2021-04-15 — — US disclosed
US-20200109263-A1 TIRE RUBBER COMPOSITION AND TIRE BRIDGESTONE CORPORATION (JP) 2020-04-09 — — US disclosed
EP-3549979-A1 RUBBER ADDITIVE, RUBBER COMPOSITION, AND TIRE IN WHICH SAME IS USED Bridgestone Corporation (JP) 2019-10-09 — — 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 (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-20210108048-A1 ADDITIVE FOR RUBBER, RUBBER COMPOSITION, AND TIRE USING THE SAME HEATR1, HRH2, ATR MAPT 3729/4885GAA 4469/4885KDM4E 3010/4885
US-11339272-B2 Additive for rubber, rubber composition, and tire using the same HEATR1, HRH2, ATR MAPT 3729/4885GAA 4469/4885KDM4E 3010/4885

“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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