SCHEMBL17076880

SCHEMBL17076880

Cc1cc(N)ccc1N1C[C@@H]2C[C@H]1CO2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ THRB P10828 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ NR4A1 P22736 1/20 0.42
▸ PTK2B Q14289 1/20 0.42
▸ MAP3K12 Q12852 15/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ RAD52 P43351 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ MTOR P42345 2/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ MAP3K13 O43283 1/20 0.38

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
SCHEMBL30336517 0.83 MAP3K12 (0.42) MAPTALDH1A1MAP3K12LMNAGFER
SCHEMBL3413852 0.76 MAP3K12 (0.47) MAP3K12
SCHEMBL2577774 0.76 MAP3K12 (0.49) MAP3K12MTORPIK3CA
SCHEMBL15399356 0.75 MAP3K12 (0.44) MAP3K12MTORPIK3CAMAP3K13
SCHEMBL15399039 0.75 MAP3K12 (0.44) MAP3K12MTORPIK3CAMAP3K13
SCHEMBL19221771 0.75 MAP3K12 (0.44) MAP3K12MTORPIK3CAMAP3K13
SCHEMBL30912434 0.75 MAPT (0.45) MAPTMEN1ALDH1A1THRBKMT2A
SCHEMBL30912529 0.75 MAPT (0.45) MAPTMEN1ALDH1A1THRBKMT2A
SCHEMBL13657915 0.75 MAPT (0.45) MAPTMEN1ALDH1A1THRBKMT2A
SCHEMBL3413859 0.75 MAPT (0.45) MAPTMEN1ALDH1A1THRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 — — US disclosed
US-20180305356-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2018-10-25 — — US disclosed
US-10000482-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2018-06-19 — — US disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 — — US disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 — — US disclosed
US-20150259340-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-17 — — 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 (5 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-20150259340-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK MAPT 470/4885MEN1 544/4885ALDH1A1 4333/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK MAPT 501/4885MEN1 1218/4885ALDH1A1 3674/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK MAPT 470/4885MEN1 544/4885ALDH1A1 4333/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK MAPT 438/4885MEN1 636/4885ALDH1A1 4184/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK MAPT 438/4885MEN1 636/4885ALDH1A1 4184/4885

“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.

Send feedback