SCHEMBL2887263

SCHEMBL2887263

CC(C)Sc1ccc2c(n1)OCCN(Cc1ccccc1)C2=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
MAPK1 P28482 3/20 0.40
TNIK Q9UKE5 3/20 0.40
ROCK2 O75116 8/20 0.38
ROCK1 Q13464 7/20 0.38
GRM5 P41594 2/20 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
SCHEMBL13207964 0.79 PRMT5 (0.45) PRMT5WDR77MAPK1TNIKROCK2
SCHEMBL2891149 0.79 ROCK2 (0.44) PRMT5WDR77MAPK1TNIKROCK2
SCHEMBL2890616 0.76 CYP1A2 (0.39)
SCHEMBL2888874 0.76 GRM5 (0.46) PRMT5WDR77MAPK1TNIKROCK2
SCHEMBL2887054 0.72 GRM5 (0.43) PRMT5WDR77MAPK1TNIKROCK2
SCHEMBL2888645 0.72 GRM5 (0.43) PRMT5WDR77MAPK1TNIKROCK2
SCHEMBL2887253 0.70 EGLN1 (0.44) MAPK1TNIKROCK2ROCK1GRM5
SCHEMBL16488375 0.70 DDB1 (0.47) MAPK1GRM5
SCHEMBL11985664 0.69 PRMT5 (0.49) PRMT5WDR77MAPK1TNIKROCK2
SCHEMBL1775226 0.66 MAPK1 (0.42) MAPK1TNIKROCK2ROCK1GRM5

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
EP-2213675-B1 PYRIDOOXAZEPINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2013-08-14 EP disclosed
US-8329687-B2 Pyridooxazepine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-11 US disclosed
US-20100286120-A1 PYRIDOOXAZEPINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-11-11 US disclosed
EP-2213675-A1 PYRIDOOXAZEPINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2010-08-04 EP 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-20100286120-A1 PYRIDOOXAZEPINE DERIVATIVE AND USE THEREOF HTR2C, HTR2A, TPH2 PRMT5 1000/4885WDR77 3631/4885MAPK1 489/4885

“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.