SCHEMBL5415946

SCHEMBL5415946

COCCNC(=O)c1ccc2[nH]ncc2c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.57
METTL3 Q86U44 1/20 0.55
ITK Q08881 1/20 0.54
MAOA P21397 2/20 0.54
HPGD P15428 1/20 0.53
RPS6KB1 P23443 1/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
CTNNB1 P35222 2/20 0.52
WNT3A P56704 2/20 0.52
ROCK2 O75116 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TRPA1 O75762 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
SCHEMBL5404528 0.92 ALDH1A1 (0.58) MAOBMETTL3MAOAHPGDNPC1
SCHEMBL5404361 0.86 MAOB (0.59) MAOBMETTL3MAOARPS6KB1NPC1
SCHEMBL5407158 0.85 MAOB (0.60) MAOBMETTL3HPGDRPS6KB1NPC1
SCHEMBL19086030 0.83 MAOB (0.62) MAOBMETTL3MAOARPS6KB1NPC1
SCHEMBL5415980 0.83 HTT (0.56) MAOBMETTL3MAOANPC1RAB9A
SCHEMBL5413397 0.83 MAOB (0.56) MAOBMETTL3MAOAHPGDRPS6KB1
SCHEMBL14514474 0.83 MAOB (0.58) MAOBMETTL3MAOAHPGDRPS6KB1
SCHEMBL30908111 0.81 NAMPT (0.53) ITKHPGDMEN1KMT2A
SCHEMBL5415090 0.81 HPGD (0.58) MAOBMETTL3HPGDRPS6KB1NPC1
SCHEMBL27836079 0.81 MAOB (0.58) MAOBMETTL3MAOARPS6KB1NPC1

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
US-7220771-B2 Methods of using indazole derivatives as JNK inhibitors SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-22 US disclosed
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 2025/4885METTL3 3310/4885ITK 1422/4885

“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.