SCHEMBL21057248

SCHEMBL21057248

Nc1nccn2c(C3CCCC4(CC4)C3)nnc12

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.45
FGFR2 P21802 1/20 0.34
AHCY P23526 1/20 0.34
TNK2 Q07912 14/20 0.34
FGFR1 P11362 2/20 0.33
IGF1R P08069 1/20 0.33

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
SCHEMBL21138157 0.88 ADORA3 (0.50) ADORA3AHCYTNK2
SCHEMBL21138193 0.86 ADORA3 (0.44) ADORA3FGFR2AHCYTNK2IGF1R
SCHEMBL19917191 0.86 ADORA3 (0.44) ADORA3FGFR2AHCYTNK2IGF1R
SCHEMBL21057310 0.86 ADORA3 (0.47) ADORA3FGFR2AHCYTNK2FGFR1
SCHEMBL21057510 0.86 ADORA3 (0.44) ADORA3FGFR2AHCYTNK2IGF1R
SCHEMBL21138377 0.85 HSD11B1 (0.36) ADORA3
SCHEMBL21138747 0.83 ADORA3 (0.53) ADORA3FGFR2TNK2FGFR1IGF1R
SCHEMBL21138169 0.83 ADORA3 (0.53) ADORA3FGFR2AHCYTNK2IGF1R
SCHEMBL21159596 0.82 ADORA3 (0.44) ADORA3FGFR2AHCYTNK2IGF1R
SCHEMBL21057503 0.82 ADORA3 (0.52) ADORA3FGFR2TNK2IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3505171-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2019-07-03 EP claimed
US-20190185479-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-06-20 US claimed
US-20260060970-A1 Use of a Therapeutic Agent with Phosphodiesterase-7 Inhibitory Activity for the Treatment and Prevention of Diseases Associated with Chronic Fatigue, Exhaustion and/or Exertional Intolerance MITODICURE GMBH (DE) 2026-03-05 US disclosed
EP-3505171-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2019-07-03 EP disclosed
EP-3505171-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2019-07-03 EP disclosed
US-20190185479-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-06-20 US disclosed
US-20190185479-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-06-20 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 (2 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-20260060970-A1 Use of a Therapeutic Agent with Phosphodiesterase-7 Inhibitory Activity for the Treatment and Prevention of Diseases Associated with Chronic Fatigue, Exhaustion and/or Exertional Intolerance PDE5A, PDE4C, PDE12 ADORA3 3356/4885FGFR2 4251/4885AHCY 1944/4885
US-20190185479-A1 BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND PDE7B, PDE3A, PDE7A ADORA3 1484/4885FGFR2 4051/4885AHCY 1959/4885

“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.