SCHEMBL4517050

SCHEMBL4517050

CCc1c[nH]c(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)n1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 13/20 0.54
POLB P06746 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
CRHR1 P34998 1/20 0.39
BCL6 P41182 1/20 0.38
STK17A Q9UEE5 1/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 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
SCHEMBL4518773 0.85 GRM5 (0.61) GRM5MAPTBCL6
SCHEMBL4505307 0.81 GRM5 (0.57) GRM5POLBLMNAMAPTHTT
SCHEMBL4530571 0.77 GRM5 (0.67) GRM5MAPTCRHR1BCL6STK17A
SCHEMBL4516647 0.77 GRM5 (0.57) GRM5HTTBCL6
SCHEMBL4519571 0.75 GRM5 (0.80) GRM5POLBLMNAMAPTHTT
SCHEMBL4518707 0.74 GRM5 (0.71) GRM5BCL6
SCHEMBL4508452 0.73 GRM5 (0.50) GRM5LMNAHTTBCL6STK17A
SCHEMBL4511277 0.73 GRM5 (0.50) GRM5MAPTBCL6
SCHEMBL3632867 0.72 KDR (0.54) GRM5POLBLMNAMAPT
SCHEMBL4522729 0.72 GRM5 (0.51) GRM5

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 3095/4885POLB 1633/4885LMNA 1809/4885

“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.