SCHEMBL15034516

SCHEMBL15034516

Cc1ccc(-c2cn(-c3ccc(F)cc3)c(CC(=O)N3CCN(c4cccnn4)CC3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.50
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLC6A7 Q99884 1/20 0.41
MAPT P10636 6/20 0.40
TP53 P04637 3/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL15034514 0.96 GRM5 (0.49) GRM5SLC6A7MAPTMEN1KMT2A
SCHEMBL15034524 0.91 L3MBTL1 (0.49) GRM5SMN1; SMN2SLC6A7MAPTTP53
SCHEMBL15034541 0.90 GRM5 (0.64) GRM5SLC6A7
SCHEMBL15034519 0.89 KDM4E (0.57) GRM5KDM4ESMN1; SMN2MAPTMEN1
SCHEMBL15034536 0.89 GRM5 (0.54) GRM5KDM4ESLC6A7LMNAMEN1
SCHEMBL15034517 0.86 GRM5 (0.58) GRM5KDM4ESMN1; SMN2SLC6A7MAPT
SCHEMBL15034513 0.84 GRM5 (0.55) GRM5KDM4ESMN1; SMN2MAPTLMNA
SCHEMBL15034518 0.82 GRM5 (0.53) GRM5KDM4ESMN1; SMN2MAPTMEN1
SCHEMBL15034521 0.81 GRM5 (0.48) GRM5SMN1; SMN2MAPTTP53LMNA
SCHEMBL15034520 0.81 LMNA (0.42) GRM5SMN1; SMN2MAPTTP53LMNA

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 1/4885KDM4E 1915/4885SMN1; SMN2 2436/4885

“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.