SCHEMBL10093234

SCHEMBL10093234

COc1cc(C(=O)N2CC[C@H](F)C2)ccc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.54
▸ LRRK2 Q5S007 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ HTR4 Q13639 4/20 0.47
▸ ALDH1A1 P00352 5/20 0.45
▸ PKM P14618 1/20 0.45
▸ CHRM4 P08173 1/20 0.45
▸ CHRM5 P08912 1/20 0.45
▸ ADRA2C P18825 1/20 0.45
▸ CHRM3 P20309 1/20 0.45
▸ HTR1D P28221 1/20 0.45
▸ ADRA1B P35368 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ HTR3A P46098 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ ROCK2 O75116 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL15650148 1.00 HSD11B1 (0.54) HSD11B1LRRK2LMNAHTR4ALDH1A1
SCHEMBL15653410 1.00 HSD11B1 (0.54) HSD11B1LRRK2LMNAHTR4ALDH1A1
SCHEMBL15651498 0.92 HSD11B1 (0.59) HSD11B1LRRK2LMNAHTR4ALDH1A1
SCHEMBL15652121 0.91 HSD11B1 (0.49) HSD11B1LMNAHTR4ALDH1A1CHRM4
SCHEMBL29531684 0.90 HSD11B1 (0.54) HSD11B1LMNAHTR4
SCHEMBL15651433 0.87 HSD11B1 (0.54) HSD11B1LRRK2LMNAHTR4ALDH1A1
SCHEMBL14068213 0.87 HSD11B1 (0.54) HSD11B1LRRK2LMNAHTR4ALDH1A1
SCHEMBL15650487 0.87 HSD11B1 (0.54) HSD11B1LRRK2LMNAHTR4ALDH1A1
SCHEMBL13575562 0.87 HSD11B1 (0.59) HSD11B1LMNAHTR4ALDH1A1CHRM4
SCHEMBL29530995 0.87 HSD11B1 (0.59) HSD11B1LMNAHTR4ALDH1A1CHRM4

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 10 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
EP-2010542-B1 4,5-DIHYDRO-[1,2,4]TRIAZOLO[4,3-F]PTERIDINES AS PLK1 PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMA (US) 2012-01-25 — — EP disclosed
WO-2011038185-A2 METHODS FOR PREPARING PYRIMIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-31 — — WO disclosed
WO-2007120752-A2 4, 5-DIHYDRO- [1, 2, 4] TRIAZOLO [4, 3-F] PTERIDINES AS PROTEIN KINASE PLK1 INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-10-25 — — WO disclosed
WO-2007095188-A2 DIHYDRODIAZEPINES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-23 — — WO 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 HSD11B1 3408/4885LRRK2 1/4885LMNA 3015/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK HSD11B1 4122/4885LRRK2 1/4885LMNA 3243/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK HSD11B1 3408/4885LRRK2 1/4885LMNA 3015/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK HSD11B1 3523/4885LRRK2 1/4885LMNA 3115/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK HSD11B1 3523/4885LRRK2 1/4885LMNA 3115/4885

“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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