SCHEMBL15034545

SCHEMBL15034545

Cc1cc(-c2cn(-c3ccc(F)cc3)c(CC(=O)N3CCN(c4ncncn4)CC3)n2)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 16/20 0.53
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.37

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
SCHEMBL15034542 0.92 GRM5 (0.61) GRM5
SCHEMBL15034539 0.92 GRM5 (0.51) GRM5POLBMEN1KMT2ALMNA
SCHEMBL15023709 0.90 GRM5 (0.49) GRM5POLBMEN1KMT2A
SCHEMBL15034521 0.90 GRM5 (0.48) GRM5POLBMEN1KMT2ALMNA
SCHEMBL15034565 0.86 GRM5 (0.68) GRM5
SCHEMBL15034561 0.86 GRM5 (0.67) GRM5LMNA
SCHEMBL15034529 0.85 L3MBTL1 (0.52) GRM5MEN1KMT2A
SCHEMBL15034540 0.85 GRM5 (0.70) GRM5KMT2A
SCHEMBL15034557 0.84 POLB (0.46) GRM5POLBMEN1KMT2ALMNA
SCHEMBL15034535 0.84 GRM5 (0.60) GRM5LMNA

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-8937176-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-01-20 US disclosed
US-8937176-B2 Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-01-20 US disclosed
US-20130158038-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-20 US disclosed
US-20130158038-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-20 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-20130158038-A1 NOVEL COMPOUNDS GRM5, GRIN1, GRM1 GRM5 1/4885POLB 3835/4885MEN1 4795/4885

“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.