SCHEMBL4183909

SCHEMBL4183909

Cc1ccccc1-c1cc2cnc(NN3CC4CCCC4C3)nc2n(CC(=O)NC(C)C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 15/20 0.43
SRC P12931 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PAK1 Q13153 1/20 0.38
SIK1 P57059 1/20 0.37
SIK2 Q9H0K1 1/20 0.37
SIK3 Q9Y2K2 1/20 0.37
LYN P07948 1/20 0.37
BTK Q06187 1/20 0.37

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
SCHEMBL4176364 0.90 TNK2 (0.43) TNK2KDM4EALDH1A1PAK1
SCHEMBL4192971 0.90 ALDH1A1 (0.44) TNK2KDM4EALDH1A1PAK1
SCHEMBL4182490 0.90 TNK2 (0.45) TNK2SRCPAK1SIK1SIK2
SCHEMBL4173726 0.89 TNK2 (0.44) TNK2SRCPAK1SIK1SIK2
SCHEMBL13928696 0.87 TNK2 (0.44) TNK2SRCPAK1LYNBTK
SCHEMBL4186281 0.87 TNK2 (0.45) TNK2SRCKDM4EPAK1
SCHEMBL4169005 0.86 PAK1 (0.49) TNK2PAK1SIK1SIK2SIK3
SCHEMBL4168908 0.85 PAK1 (0.50) TNK2PAK1SIK1SIK2SIK3
SCHEMBL4180916 0.85 TNK2 (0.49) TNK2PAK1SIK2
SCHEMBL4179436 0.85 TNK2 (0.43) TNK2SRCPAK1SIK1SIK2

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-20090036472-A1 AZABICYCLO DERIVATIVES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-02-05 US claimed
US-20090036472-A1 AZABICYCLO DERIVATIVES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-02-05 US disclosed
US-20090036472-A1 AZABICYCLO DERIVATIVES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-02-05 US disclosed
US-20090036472-A1 AZABICYCLO DERIVATIVES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-02-05 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-20090036472-A1 AZABICYCLO DERIVATIVES AS ANTI-INFLAMMATORY AGENTS IL1B, TPMT, IL1R1 TNK2 994/4885SRC 3064/4885KDM4E 1611/4885

“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.