SCHEMBL3060075

SCHEMBL3060075

Cc1cnccc1C(=O)N(Cc1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
TSHR P16473 1/20 0.53
PDK1 Q15118 17/20 0.52
PDK2 Q15119 2/20 0.48
PDK4 Q16654 2/20 0.48
HSP90AA1 P07900 1/20 0.48
PDK3 Q15120 1/20 0.48
NOS3 P29474 1/20 0.47
NOS1 P29475 1/20 0.47
NOS2 P35228 1/20 0.47

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
SCHEMBL3057449 0.95 GAA (0.53) GAATSHRPDK1PDK2PDK4
SCHEMBL3065409 0.91 GAA (0.63) GAATSHRPDK1PDK2PDK4
SCHEMBL3061621 0.90 GAA (0.55) GAATSHRPDK1PDK2PDK4
SCHEMBL3056522 0.89 ATF1 (0.57) GAATSHRPDK1PDK2PDK4
SCHEMBL3050032 0.89 NOS3 (0.55) GAATSHRPDK1PDK2PDK4
SCHEMBL3053783 0.88 GAA (0.51) GAATSHRPDK1PDK2PDK4
SCHEMBL3054727 0.88 GAA (0.53) GAATSHRPDK1PDK2PDK4
SCHEMBL3052473 0.87 NOS3 (0.61) GAATSHRPDK1PDK2PDK4
SCHEMBL3061886 0.87 PDK1 (0.50) GAATSHRPDK1PDK2PDK4
SCHEMBL3067697 0.87 NOS3 (0.54) GAATSHRPDK1NOS3NOS1

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-20100261758-A1 HETEROCYCLIC AMIDES FOR USE AS PHARMACEUTICALS NOVARTIS AG (CH) 2010-10-14 US disclosed
CN-101405268-A Amide derivatives and their use for the treatment of protein-related diseases NOVARTIS AG (CH) 2009-04-08 CN disclosed
EP-2001851-A2 AMIDE DERIVATIVES AND THEIR APPLICATION FOR THE TREAMENT OF G PROTEIN RELATED DISEASES Novartis AG (CH) 2008-12-17 EP disclosed
WO-2007110237-A2 AMIDE DERIVATIVES AND THEIR APPLICATION FOR THE TREATMENT OF G PROTEIN RELATED DISEASES NOVARTIS AG (CH) 2007-10-04 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-20100261758-A1 HETEROCYCLIC AMIDES FOR USE AS PHARMACEUTICALS HRH4, CNR1, CNR2 GAA 1212/4885TSHR 384/4885PDK1 2335/4885

“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.