SCHEMBL409364

SCHEMBL409364

COc1ccc(Nc2cnc3[nH]c4c(c3c2)CN(C(=O)OC(C)(C)C)CC4)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
BAZ2B Q9UIF8 2/20 0.45
MKNK1 Q9BUB5 3/20 0.44
CFTR P13569 6/20 0.44
ALDH1A1 P00352 1/20 0.44
KDM4E B2RXH2 1/20 0.42
EP300 Q09472 1/20 0.40
CREBBP Q92793 1/20 0.40
KDR P35968 1/20 0.39
P2RX3 P56373 1/20 0.39

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
SCHEMBL407463 0.91 MKNK1 (0.55) MAPTBAZ2BMKNK1CFTREP300
SCHEMBL406798 0.91 MAPT (0.45) MAPTBAZ2BMKNK1CFTRALDH1A1
SCHEMBL18106971 0.86 MAPT (0.42) MAPTBAZ2BMKNK1CFTRALDH1A1
SCHEMBL407207 0.86 MAPT (0.49) MAPTMKNK1CFTRALDH1A1KDM4E
SCHEMBL404753 0.80 BAZ2B (0.48) MAPTBAZ2BMKNK1CFTR
SCHEMBL30667649 0.79 MAPT (0.46) MAPTBAZ2BMKNK1CFTRKDM4E
SCHEMBL18106974 0.78 EP300 (0.43) BAZ2BMKNK1CFTREP300CREBBP
SCHEMBL30506408 0.77 BAZ2B (0.61) MAPTBAZ2BCFTRKDM4EKDR
SCHEMBL30228575 0.77 BAZ2B (0.74) BAZ2BCFTRKDR
SCHEMBL21114768 0.77 BAZ2B (0.61) MAPTBAZ2BCFTRKDM4EKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367822-B1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2016-10-05 EP claimed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US claimed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US claimed
EP-2367822-A1 TRICYCLIC AZAINDOLES Merck Patent GmbH (DE) 2011-09-28 EP claimed
WO-2010080253-A1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2010-07-15 WO claimed
EP-2367822-B1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2016-10-05 EP disclosed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-8853391-B2 Tricyclic azaindoles MERCK PATENT GMBH (DE) 2014-10-07 US disclosed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US disclosed
US-20120022060-A1 Tricyclic Azaindoles MERCK PATENT GMBH (DE) 2012-01-26 US disclosed
WO-2010080253-A1 TRICYCLIC AZAINDOLES MERCK PATENT GMBH (DE) 2010-07-15 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-20120022060-A1 Tricyclic Azaindoles AZI2, DCK, PPP2CA MAPT 2520/4885BAZ2B 506/4885MKNK1 54/4885

“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.