SCHEMBL4528975

SCHEMBL4528975

CCn1ccnc1-c1ccc(Nc2ccc(Cl)cc2)nc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 10/20 0.44
BRD4 O60885 1/20 0.37
NPC1 O15118 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TNIK Q9UKE5 1/20 0.36
MAPT P10636 1/20 0.36
PDE10A Q9Y233 1/20 0.36
BRAF P15056 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
SCHEMBL4513339 0.91 GRM5 (0.48) GRM5BRD4TNIKMAPT
SCHEMBL4517225 0.87 BRD4 (0.40) GRM5BRD4MAPTPDE10ABRAF
SCHEMBL4524435 0.84 LIMK2 (0.50) BRD4MAPT
SCHEMBL4514307 0.83 GRM5 (0.40) GRM5BRD4
SCHEMBL4515632 0.83 GRM5 (0.43) GRM5NPC1RAB9AMAPTPDE10A
SCHEMBL4522322 0.81 GRM5 (0.40) GRM5NPC1RAB9AMAPTPDE10A
SCHEMBL15201143 0.81 BRD4 (0.47) BRD4
SCHEMBL4522628 0.81 GRM5 (0.61) GRM5BRD4TSHRMAPT
SCHEMBL4519722 0.77 KDR (0.45) GRM5NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4523983 0.74 GRM5 (0.71) GRM5BRD4

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 7 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
US-20090286827-A1 NOVEL BI-ARYL AMINES NOVARTIS AG (CH) 2009-11-19 US disclosed
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
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 3095/4885BRD4 435/4885NPC1 564/4885

“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.