SCHEMBL18512268

SCHEMBL18512268

CCOC(=O)CCc1cccc(C2COC2)c1OC

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 3/20 0.48
▸ CYP4A11 Q02928 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.38
▸ POLB P06746 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ CDYL Q9Y232 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NLRP3 Q96P20 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL18512250 0.81 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1GAAKDM4E
SCHEMBL14874345 0.78 CYP4F2 (0.59) CYP4F2CYP4A11ALDH1A1GAAKDM4E
SCHEMBL5379790 0.78 CYP4F2 (0.59) CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2
SCHEMBL490337 0.77 CYP4F2 (0.57) CYP4F2CYP4A11ALDH1A1GAAKDM4E
SCHEMBL7293339 0.76 CYP4F2 (0.56) CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2
SCHEMBL20201867 0.76 CYP4F2 (0.56) CYP4F2CYP4A11ALDH1A1GAAKDM4E
SCHEMBL30798905 0.75 CYP4F2 (0.55) CYP4F2CYP4A11ALDH1A1GAAKDM4E
SCHEMBL14874376 0.74 CYP4F2 (0.54) CYP4F2CYP4A11ALDH1A1GAAPOLB
SCHEMBL18512248 0.73 L3MBTL1 (0.45) ALDH1A1KDM4ESMN1; SMN2KMT2AMAPT
SCHEMBL69660 0.71 CYP4F2 (0.86) CYP4F2CYP4A11ALDH1A1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9783522-B2 2-amino-pyridine and 2-amino-pyrimidine derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-10-10 — — US disclosed
US-9783522-B2 2-amino-pyridine and 2-amino-pyrimidine derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-10-10 — — US disclosed
US-20170044133-A1 NOVEL 2-AMINO-PYRIDINE AND 2-AMINO-PYRIMIDINE DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-16 — — US disclosed
US-20170044133-A1 NOVEL 2-AMINO-PYRIDINE AND 2-AMINO-PYRIMIDINE DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-16 — — 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-20170044133-A1 NOVEL 2-AMINO-PYRIDINE AND 2-AMINO-PYRIMIDINE DERIVATIVES AND MEDICINAL USE THEREOF ENPP2, ATXN2, ATXN2L CYP4F2 3049/4885CYP4A11 3988/4885ALDH1A1 3768/4885

“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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