SCHEMBL5408622

SCHEMBL5408622

COc1cccc(CNC(=O)c2ccc3[nH]ncc3c2)c1OC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.58
MAOA P21397 3/20 0.58
ROCK2 O75116 5/20 0.58
ROCK1 Q13464 3/20 0.58
POLB P06746 2/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
METTL3 Q86U44 1/20 0.51
NAMPT P43490 1/20 0.51

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
SCHEMBL5412630 0.90 ROCK2 (0.64) MAOBMAOAROCK2ROCK1POLB
SCHEMBL5413303 0.87 MAOB (0.59) MAOBMAOAROCK2ROCK1POLB
SCHEMBL5414851 0.82 ROCK2 (0.58) MAOBMAOAROCK2ROCK1POLB
SCHEMBL5413451 0.82 MAPT (0.62) MAOBMAOAROCK2ROCK1NPC1
SCHEMBL5409039 0.80 MAPT (0.60) MAOBROCK2ROCK1TP53MAPT
SCHEMBL5419152 0.80 MAOB (0.67) MAOBMAOAROCK2MEN1KMT2A
SCHEMBL5419581 0.79 ROCK2 (0.62) MAOBROCK2ROCK1MEN1KMT2A
SCHEMBL5418304 0.79 ROCK2 (0.83) MAOBROCK2ROCK1NPC1RAB9A
SCHEMBL5413661 0.78 MAOB (0.56) MAOBROCK2ROCK1NPC1RAB9A
SCHEMBL5418918 0.78 MAOB (0.58) MAOBROCK2ROCK1NPC1RAB9A

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 MAOB 2025/4885MAOA 2003/4885ROCK2 2/4885

“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.