SCHEMBL15034535

SCHEMBL15034535

Cc1cc(-c2cn(-c3ccc(F)cc3)c(CC(=O)N3CCN(c4ncccn4)CC3)n2)ccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.60
CETP P11597 1/20 0.45
SLC6A7 Q99884 1/20 0.43
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SCN9A Q15858 1/20 0.41

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
SCHEMBL15034539 0.93 GRM5 (0.51) GRM5CETPLMNA
SCHEMBL15034542 0.92 GRM5 (0.61) GRM5SLC6A7KDM4EL3MBTL1SCN9A
SCHEMBL15034534 0.91 GRM5 (0.59) GRM5KDM4EALDH1A1
SCHEMBL15034510 0.89 GRM5 (0.60) GRM5SLC6A7KDM4EPTGS1PTGS2
SCHEMBL15034517 0.88 GRM5 (0.58) GRM5SLC6A7KDM4EL3MBTL1ALDH1A1
SCHEMBL15034536 0.87 GRM5 (0.54) GRM5SLC6A7KDM4ELMNA
SCHEMBL15034561 0.85 GRM5 (0.67) GRM5KDM4ELMNA
SCHEMBL15034538 0.85 GRM5 (0.55) GRM5CETPL3MBTL1ALDH1A1
SCHEMBL15034545 0.84 GRM5 (0.53) GRM5LMNA
SCHEMBL15034523 0.84 GRM5 (0.53) GRM5SLC6A7L3MBTL1ALDH1A1SCN9A

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 1/4885CETP 2712/4885SLC6A7 1370/4885

“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.