SCHEMBL3311608

SCHEMBL3311608

CC(c1cn[nH]c1)N1CC(Nc2ccc3cnccc3c2)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 3/20 0.35
▸ ROCK2 O75116 9/20 0.35
▸ PRMT3 O60678 6/20 0.35
▸ ROCK1 Q13464 3/20 0.35
▸ DDX3X O00571 1/20 0.34

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
SCHEMBL3316815 0.81 IMPDH2 (0.42) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3313045 0.76 PRMT3 (0.41) IMPDH2ROCK2PRMT3DDX3X
SCHEMBL3313256 0.75 PRMT3 (0.40) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3313248 0.75 PRMT3 (0.40) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3315470 0.75 ROCK2 (0.46) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3319897 0.73 ROCK2 (0.51) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3315427 0.72 HRH3 (0.45) IMPDH2ROCK2PRMT3ROCK1
SCHEMBL3314413 0.72 HTR2A (0.40) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3314417 0.72 HTR2A (0.40) IMPDH2ROCK2PRMT3ROCK1DDX3X
SCHEMBL3311391 0.72 PRMT3 (0.43) IMPDH2ROCK2PRMT3ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748614-B2 Substituted isoquinoline and isoquinolinone derivatives SANOFI (FR) 2014-06-10 — — US disclosed
US-20100105650-A1 Substituted isoquinoline and isoquinolinone derivatives SANOFI-AVENTIS (FR) 2010-04-29 — — US 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-20100105650-A1 Substituted isoquinoline and isoquinolinone derivatives MYLK2, MYLK, MYLK3 IMPDH2 384/4885ROCK2 6/4885PRMT3 716/4885

“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.

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