SCHEMBL2203595

SCHEMBL2203595

COc1ccc(-c2cc(C(=O)NCCc3ccc(OC)c(OC)c3)cc(-n3cnnn3)c2)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
POLB P06746 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 3/20 0.48
LMNA P02545 3/20 0.48
MAPK1 P28482 1/20 0.47
ROCK2 O75116 1/20 0.47
ROCK1 Q13464 1/20 0.47
TSHR P16473 2/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL2205307 0.94 MAPT (0.52) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL2203190 0.93 MAPT (0.49) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL13875282 0.91 MAPT (0.49) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL2203582 0.90 MAPT (0.56) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL15327804 0.89 ALDH1A1 (0.50) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL2203117 0.87 RAB9A (0.52) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL2206210 0.86 GAA (0.56) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL2204512 0.86 GAA (0.57) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL2203911 0.86 ALDH1A1 (0.49) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL2204375 0.86 MAPK1 (0.57) MAPTKMT2AMEN1POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981914-B2 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2011-07-19 US claimed
US-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 US claimed
EP-2205573-B1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2013-10-23 EP disclosed
US-7981914-B2 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2011-07-19 US disclosed
US-7981914-B2 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2011-07-19 US disclosed
US-7981914-B2 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2011-07-19 US disclosed
US-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 US disclosed
US-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 US disclosed
WO-2009043780-A1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2009-04-09 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-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof AR, NAT1, TBXA2R MAPT 1160/4885KMT2A 1756/4885MEN1 1261/4885

“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.