SCHEMBL15025847

SCHEMBL15025847

COc1ccnc(N2CCN(C(=O)Cn3cc(-c4ccc(F)c(C)c4)nc3C3CCCCC3)CC2)c1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 11/20 0.78
RPS6KB1 P23443 5/20 0.45
AKT1 P31749 5/20 0.45
GRIN2B Q13224 4/20 0.43

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
SCHEMBL15025982 0.88 GRM5 (0.73) GRM5RPS6KB1AKT1
SCHEMBL15025981 0.88 GRM5 (1.00) GRM5RPS6KB1AKT1
SCHEMBL15025665 0.85 GRM5 (0.89) GRM5
SCHEMBL15025657 0.85 GRM5 (0.84) GRM5RPS6KB1AKT1
SCHEMBL15115111 0.85 GRM5 (0.58) GRM5GRIN2B
SCHEMBL14982339 0.85 GRM5 (0.62) GRM5GRIN2B
SCHEMBL15025903 0.85 GRM5 (1.00) GRM5
SCHEMBL15115153 0.84 GRM5 (0.59) GRM5GRIN2B
SCHEMBL14982348 0.81 GRM5 (0.65) GRM5GRIN2B
SCHEMBL15115175 0.79 GRM5 (0.58) GRM5GRIN2B

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-8846948-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-30 US disclosed
US-8846948-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-30 US disclosed
US-20130150355-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 US disclosed
US-20130150355-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-13 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-20130150355-A1 NOVEL COMPOUNDS GRM5, GRIN2A, GRIN1 GRM5 1/4885RPS6KB1 1038/4885AKT1 1307/4885

“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.