SCHEMBL248886

SCHEMBL248886

Cc1cc(-c2ccc(CNC(=O)c3ccc(-c4ccccc4)cc3)cc2)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.64
RPS6KA5 O75582 1/20 0.64
MAP4K4 O95819 1/20 0.64
PRKCG P05129 1/20 0.64
PRKACA P17612 1/20 0.64
RPS6KB1 P23443 1/20 0.64
MAPK1 P28482 1/20 0.64
AKT1 P31749 1/20 0.64
GSK3A P49840 1/20 0.64
GSK3B P49841 1/20 0.64
PRKX P51817 1/20 0.64
PRKCD Q05655 1/20 0.64
PRKG2 Q13237 1/20 0.64
ROCK1 Q13464 1/20 0.64
DYRK1A Q13627 1/20 0.64
PRKG1 Q13976 1/20 0.64
PKN2 Q16513 1/20 0.64
CDC42BPA Q5VT25 1/20 0.64
CLK4 Q9HAZ1 1/20 0.64
SGK2 Q9HBY8 1/20 0.64

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
SCHEMBL246715 0.90 WNT3A (0.61) ROCK2RPS6KA5MAP4K4PRKCGPRKACA
SCHEMBL247951 0.90 WNT3A (0.59) ROCK2RPS6KA5MAP4K4PRKCGPRKACA
SCHEMBL248751 0.87 PSEN1 (0.59) ROCK2RPS6KA5MAP4K4PRKCGPRKACA
SCHEMBL248978 0.86 WNT3A (0.58) WNT3A
SCHEMBL248089 0.84 WNT3A (0.60) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL25046020 0.81 LMNA (0.69) ROCK2RPS6KA5MAP4K4PRKCGPRKACA
SCHEMBL248624 0.81 WNT3A (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1927145 0.81 EPHX2 (0.77) ROCK2RPS6KA5MAP4K4PRKCGPRKACA
SCHEMBL247565 0.81 WNT3A (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14009849 0.81 MMP13 (0.61) ROCK2RPS6KA5MAP4K4PRKCGPRKACA

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181235-B2 Substituted pyridines for modulating the WNT signaling pathway NOVARTIS AG (CH) 2015-11-10 US disclosed
US-9181235-B2 Substituted pyridines for modulating the WNT signaling pathway NOVARTIS AG (CH) 2015-11-10 US disclosed
US-9181235-B2 Substituted pyridines for modulating the WNT signaling pathway NOVARTIS AG (CH) 2015-11-10 US disclosed
EP-2588453-B1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY NOVARTIS AG (CH) 2015-04-01 EP disclosed
EP-2588453-B1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY NOVARTIS AG (CH) 2015-04-01 EP disclosed
CN-102958917-B Compositions and methods for modulating the wnt signaling pathway IRM LLC (BM) 2014-10-08 CN disclosed
EP-2588453-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY IRM LLC (BM) 2013-05-08 EP disclosed
US-20130079328-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY NOVARTIS AG (CH) 2013-03-28 US disclosed
US-20130079328-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY NOVARTIS AG (CH) 2013-03-28 US disclosed
US-20130079328-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY NOVARTIS AG (CH) 2013-03-28 US disclosed
WO-2012003189-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY IRM LLC (BM) 2012-01-05 WO disclosed
WO-2012003189-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY IRM LLC (BM) 2012-01-05 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-20130079328-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY WNT3A, WNT1, WNT3 ROCK2 159/4885RPS6KA5 80/4885MAP4K4 643/4885

“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.