SCHEMBL5409039

SCHEMBL5409039

Cc1ccccc1CNC(=O)c1ccc2[nH]ncc2c1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
METTL3 Q86U44 1/20 0.59
MAOB P27338 1/20 0.58
ROCK2 O75116 3/20 0.57
ROCK1 Q13464 1/20 0.57
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
CTNNB1 P35222 2/20 0.52
WNT3A P56704 2/20 0.52
TP53 P04637 1/20 0.52
TTK P33981 1/20 0.52
CA2 P00918 1/20 0.50
PPARG P37231 1/20 0.49
SCN2A Q99250 1/20 0.49
SCN10A Q9Y5Y9 1/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL5418918 0.86 MAOB (0.58) METTL3MAOBROCK2ROCK1HPGD
SCHEMBL5412630 0.85 ROCK2 (0.64) MAPTMAOBROCK2ROCK1HPGD
SCHEMBL5407860 0.83 CTNNB1 (0.60) METTL3MAOBROCK2ROCK1CTNNB1
SCHEMBL5179231 0.83 MAOB (0.70) METTL3MAOBROCK2ROCK1ALDH1A1
SCHEMBL5413661 0.81 MAOB (0.56) METTL3MAOBROCK2ROCK1CTNNB1
SCHEMBL5441326 0.81 MAOB (0.79) METTL3MAOBROCK2ROCK1CTNNB1
SCHEMBL5406113 0.81 MAOB (0.71) MAPTMETTL3MAOBROCK2ROCK1
SCHEMBL5408622 0.80 MAOB (0.58) MAPTMETTL3MAOBROCK2ROCK1
SCHEMBL5419581 0.80 ROCK2 (0.62) METTL3MAOBROCK2ROCK1CTNNB1
SCHEMBL5442402 0.80 MAOB (0.74) METTL3MAOBROCK2ROCK1CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199147-B2 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-03 US disclosed
US-20040138286-A1 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2004-07-15 US disclosed
EP-1403255-A1 Rho KINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-31 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-20040138286-A1 Rho kinase inhibitors ROCK1, ROCK2, ARHGDIA MAPT 3261/4885METTL3 3310/4885MAOB 2025/4885

“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.