SCHEMBL3343394

SCHEMBL3343394

Cc1cc(-c2ccc(C(N)=O)c(Cl)c2)nn1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
PIK3CD O00329 1/20 0.43
ABL1 P00519 1/20 0.43
EGFR P00533 1/20 0.43
HCK P08631 1/20 0.43
SRC P12931 1/20 0.43
KDR P35968 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
MTOR P42345 1/20 0.43
EPHB4 P54760 1/20 0.43
PRKDC P78527 1/20 0.43
PI4KB Q9UBF8 1/20 0.43
CASP1 P29466 4/20 0.42
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NR2F2 P24468 1/20 0.41
HTT P42858 1/20 0.41
PDK2 Q15119 1/20 0.40

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
SCHEMBL3342117 0.83 PDE4D (0.39) MKNK1MKNK2MAPTSMN1; SMN2KDM4E
SCHEMBL3343397 0.78 CYP3A4 (0.48) MAPTSMN1; SMN2KMT2AKDM4ENPC1
SCHEMBL3346251 0.75 PARP1 (0.49) KDM4EHSD17B10PARP1
SCHEMBL29037233 0.75 MKNK1 (0.50) MKNK1MKNK2PIK3CDABL1EGFR
SCHEMBL3348778 0.74 P2RX7 (0.46) MAPTHTTNPC1HPGDRAB9A
SCHEMBL17185576 0.72 HRH3 (0.44) CASP1MAPTSMN1; SMN2PDK2KDM4E
SCHEMBL14091695 0.72 NPC1 (0.54) MAPTSMN1; SMN2KMT2AKDM4ENPC1
SCHEMBL31110200 0.70 BCAT2 (0.39) MKNK2MAPTKMT2AKDM4EHPGD
SCHEMBL3341313 0.69 HRH3 (0.43) MAPTKMT2ALMNATP53POLB
SCHEMBL23329066 0.69 TMEM97 (0.44) MAPTSMN1; SMN2KMT2AKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 US 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-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX6, P2RX3 MKNK1 2405/4885MKNK2 2356/4885PIK3CD 3158/4885

“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.