SCHEMBL4516647

SCHEMBL4516647

Cc1nc(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)[nH]c1C

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 14/20 0.57
BCL6 P41182 1/20 0.41
LRRK2 Q5S007 1/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NR1I2 O75469 1/20 0.39
AHR P35869 1/20 0.39
MET P08581 1/20 0.36
KDR P35968 1/20 0.36

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
SCHEMBL4505307 0.87 GRM5 (0.57) GRM5BCL6HTTNR1I2AHR
SCHEMBL4518773 0.81 GRM5 (0.61) GRM5BCL6MEN1KMT2AKDR
SCHEMBL3632867 0.78 KDR (0.54) GRM5MEN1KMT2AHSD17B10MET
SCHEMBL4511277 0.77 GRM5 (0.50) GRM5BCL6
SCHEMBL4517050 0.77 GRM5 (0.54) GRM5BCL6HTT
SCHEMBL27801687 0.76 NPC1 (0.48) GRM5MEN1KMT2AHSD17B10MET
SCHEMBL3633502 0.76 GRM5 (0.47) GRM5MEN1KMT2AHSD17B10MET
SCHEMBL4508452 0.74 GRM5 (0.50) GRM5BCL6LRRK2MEN1HTT
SCHEMBL23758268 0.73 MAPK1 (0.54) MEN1KMT2AHSD17B10
SCHEMBL4505177 0.72 GRM5 (1.00) GRM5BCL6MEN1KMT2A

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-20090286827-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2009-11-19 US disclosed
CN-101460478-A Novel bi-aryl amines NOVARTIS AG (CH) 2009-06-17 CN disclosed
EP-2004624-A1 NOVEL BI-ARYL AMINES Novartis AG (CH) 2008-12-24 EP disclosed
WO-2007113276-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2007-10-11 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-20090286827-A1 NOVEL BI-ARYL AMINES NAT1, MAOB, CYP2B6 GRM5 3095/4885BCL6 2305/4885LRRK2 1682/4885

“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.