SCHEMBL12598764

SCHEMBL12598764

CC1CCNC(=O)c2cc3ccc(C(=O)Nc4cccnc4)cc3n21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RPS6KA2 Q15349 13/20 1.00
RPS6KA3 P51812 9/20 1.00
MAPKAPK2 P49137 3/20 0.69

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
SCHEMBL14907208 1.00 RPS6KA2 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL3088023 0.91 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL14892002 0.91 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL12598948 0.85 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL14892228 0.85 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL14892229 0.85 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL12598758 0.85 RPS6KA2 (1.00) RPS6KA2RPS6KA3
SCHEMBL14891364 0.85 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2
SCHEMBL12598249 0.85 RPS6KA2 (1.00) RPS6KA2RPS6KA3
SCHEMBL14891361 0.85 RPS6KA3 (1.00) RPS6KA2RPS6KA3MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9150577-B2 Heterocyclic compounds containing an indole core BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 US disclosed
US-9150577-B2 Heterocyclic compounds containing an indole core BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 US disclosed
US-20130109679-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-02 US disclosed
US-20130109679-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-02 US disclosed
WO-2011071716-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-06-16 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 (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-20130109679-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BRSK2, RPS6KA2, RPS6KB2 RPS6KA2 2/4885RPS6KA3 4/4885MAPKAPK2 129/4885

“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.