SCHEMBL4502545

SCHEMBL4502545

CCCn1c(-c2cnc(Nc3ccc(Cl)cc3)c(Cl)c2)nc(C)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 14/20 1.00
MAPT P10636 1/20 0.41
BCL6 P41182 1/20 0.40
CRHR1 P34998 1/20 0.37
HTR2C P28335 1/20 0.36
P2RX3 P56373 1/20 0.35

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
SCHEMBL4510461 0.91 GRM5 (0.83) GRM5BCL6CRHR1
SCHEMBL3635677 0.83 GRM5 (1.00) GRM5MAPT
SCHEMBL3632286 0.82 GRM5 (0.82) GRM5MAPTBCL6CRHR1
SCHEMBL3634557 0.81 GRM5 (0.79) GRM5MAPT
SCHEMBL3632412 0.81 GRM5 (0.79) GRM5MAPT
SCHEMBL3634864 0.81 GRM5 (0.75) GRM5
SCHEMBL3633376 0.81 GRM5 (0.79) GRM5MAPT
SCHEMBL4508247 0.80 GRM5 (1.00) GRM5MAPTBCL6HTR2C
SCHEMBL4523983 0.79 GRM5 (0.71) GRM5BCL6
SCHEMBL4519571 0.78 GRM5 (0.80) GRM5MAPTBCL6

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 5 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
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 3095/4885MAPT 1161/4885BCL6 2305/4885

“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.