SCHEMBL3060084

SCHEMBL3060084

Cc1cnccc1C(=O)N(Cc1ccc(C#N)cc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.59
NPC1 O15118 1/20 0.59
KMT2A Q03164 1/20 0.59
PDK1 Q15118 9/20 0.52
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.50
PDK2 Q15119 1/20 0.47
PDK3 Q15120 1/20 0.47
PDK4 Q16654 1/20 0.47
CHRM2 P08172 2/20 0.46
CHRM1 P11229 2/20 0.46
CHRM3 P20309 2/20 0.46
POLB P06746 1/20 0.46
LTB4R2 Q9NPC1 2/20 0.45
MAPKAPK2 P49137 1/20 0.42
MLYCD O95822 1/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41

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
SCHEMBL3059431 0.95 MEN1 (0.59) MEN1NPC1KMT2APDK1GAA
SCHEMBL3067593 0.89 MEN1 (0.52) MEN1NPC1KMT2APDK1GAA
SCHEMBL3057621 0.89 GAA (0.50) MEN1NPC1KMT2APDK1GAA
SCHEMBL3053493 0.88 PDK1 (0.50) MEN1NPC1KMT2APDK1GAA
SCHEMBL3065409 0.88 GAA (0.63) KMT2APDK1GAATSHRPDK2
SCHEMBL3059962 0.86 GAA (0.54) PDK1GAATSHRLTB4R2
SCHEMBL3053488 0.85 MAPK14 (0.54) MEN1KMT2APDK1GAATSHR
SCHEMBL3057449 0.85 GAA (0.53) PDK1GAATSHRPDK2PDK4
SCHEMBL3062368 0.83 GAA (0.64) PDK1GAATSHR
SCHEMBL3043584 0.83 GAA (0.51) MEN1KMT2APDK1GAATSHR

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 3 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
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 MEN1 1499/4885NPC1 736/4885KMT2A 1989/4885

“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.