SCHEMBL12525466

SCHEMBL12525466

N=C(N)NC(=O)NCc1cccc(-c2cnc(N3CCN(c4cccnc4)CC3)nc2)c1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.47
▸ AOC3 Q16853 18/20 0.47

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
SCHEMBL16785052 0.87 AOC3 (0.56) ROCK2AOC3
SCHEMBL16785027 0.86 AOC3 (0.51) ROCK2AOC3
SCHEMBL16785284 0.85 AOC3 (0.52) ROCK2AOC3
SCHEMBL16785198 0.85 AOC3 (0.55) AOC3
SCHEMBL12525459 0.84 AOC3 (0.49) ROCK2AOC3
SCHEMBL12526737 0.84 AOC3 (0.61) ROCK2AOC3
SCHEMBL14993252 0.84 AOC3 (0.66) ROCK2AOC3
SCHEMBL16784931 0.84 AOC3 (0.49) ROCK2AOC3
SCHEMBL12523910 0.83 AOC3 (0.56) ROCK2AOC3
SCHEMBL16785287 0.83 AOC3 (0.55) ROCK2AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3002278-B1 GUANIDINE COMPOUND ASTELLAS PHARMA INC (JP) 2017-04-19 — — EP disclosed
US-9556160-B2 Guanidine compound ASTELLAS PHARMA INC. (JP) 2017-01-31 — — US disclosed
EP-3002278-A1 GUANIDINE COMPOUND Astellas Pharma Inc. (JP) 2016-04-06 — — EP disclosed
US-20150203480-A1 GUANIDINE COMPOUND ASTELLAS PHARMA INC. (JP) 2015-07-23 — — US disclosed
US-9051283-B2 Guanidine compound ASTELLAS PHARMA INC. (JP) 2015-06-09 — — US disclosed
WO-2012124696-A1 GUANIDINE COMPOUND アステラス製薬株式会社 (JP) 2012-09-20 — — 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-20150203480-A1 GUANIDINE COMPOUND GUCY1A1, VAPA, VAPB ROCK2 622/4885AOC3 700/4885

“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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