SCHEMBL15907136

SCHEMBL15907136

COC(=O)c1cnn2c(C(C)(C)C)nnc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
EGLN2 Q96KS0 1/20 0.37
MAPK1 P28482 2/20 0.36
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
CA14 Q9ULX7 2/20 0.34
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
POLB P06746 2/20 0.33
XDH P47989 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
NFKB1 P19838 1/20 0.33

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
SCHEMBL15907134 0.84 AURKA (0.35) EGLN2KDM4EALDH1A1CYP11B1CYP11B2
SCHEMBL15907137 0.84 HCAR2 (0.35) EGLN2KDM4EALDH1A1L3MBTL1POLB
SCHEMBL18323597 0.81 KDM4E (0.48) ATMEGLN2MAPK1KDM4EALDH1A1
SCHEMBL18323666 0.77 ATM (0.40) ATMEGLN2MAPK1KDM4EALDH1A1
SCHEMBL15907129 0.74 MAPK13 (0.47) ATMKDM4EALDH1A1SMN1; SMN2CA12
SCHEMBL15907130 0.73 MEN1 (0.47) ATMEGLN2KDM4EALDH1A1SMN1; SMN2
SCHEMBL15907113 0.73 KDM4E (0.41) ATMEGLN2KDM4EALDH1A1SMN1; SMN2
SCHEMBL15907117 0.71 KDM4E (0.36) ATMEGLN2KDM4EALDH1A1SMN1; SMN2
SCHEMBL15907138 0.70 MAPK14 (0.36) KDM4EALDH1A1LMNANFKB1HPGD
SCHEMBL15907108 0.69 KDM4E (0.34) ATMKDM4EALDH1A1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522910-B2 Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) 2016-12-20 US disclosed
US-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon OBSHCHESTVO S OGRANICHENNOY OTVETSTVENNOSTYOU "FUSION PHARMA" (RU) 2014-07-31 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-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon ABL1, ABL2, MAP3K6 ATM 467/4885EGLN2 2592/4885MAPK1 108/4885

“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.