SCHEMBL2486922

SCHEMBL2486922

COCCc1ccc(-c2cnc3c(N4CCOCC4)nccn23)cn1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 2/20 0.58
▸ PDE6A P16499 2/20 0.58
▸ PDE1B Q01064 2/20 0.58
▸ PDE3A Q14432 2/20 0.58
▸ PDE2A O00408 1/20 0.52
▸ PDE8A O60658 1/20 0.52
▸ PDE9A O76083 1/20 0.52
▸ HTR2C P28335 1/20 0.52
▸ HTR7 P34969 1/20 0.52
▸ HTR2B P41595 1/20 0.52
▸ PDE4D Q08499 1/20 0.52
▸ PDE7A Q13946 1/20 0.52
▸ PDE11A Q9HCR9 1/20 0.52
▸ PDE10A Q9Y233 1/20 0.52

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
SCHEMBL30123159 0.83 — —
SCHEMBL2483047 0.83 — —
SCHEMBL2484196 0.83 — —
SCHEMBL2482313 0.81 — —
SCHEMBL2483757 0.81 GRIA1 (0.58) —
SCHEMBL2482955 0.81 — —
SCHEMBL1820734 0.79 PDE10A (0.71) PDE5APDE6APDE1BPDE3APDE2A
SCHEMBL2484489 0.78 — —
SCHEMBL2487528 0.78 GRIA1 (0.64) PDE5APDE6APDE1BPDE3A
SCHEMBL3467020 0.76 PDE5A (0.60) PDE5APDE6APDE1BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545055-B1 Imidazo[1,2-a]pyrazine derivatives and their use for the prevention or treatment of neurological, psychiatric and metabolic disorders and diseases JANSSEN PHARMACEUTICA NV (BE) 2017-08-09 — — EP disclosed
US-8859543-B2 Imidazo[1,2-a]pyrazine derivatives and their use for the prevention or treatment of neurological, psychiatric and metabolic disorders and diseases JANSSEN PHARMACEUTICA NV (BE) 2014-10-14 — — US disclosed
EP-2545055-A1 IMIDAZO [1, 2 -A]PYRAZINE DERIVATIVES AND THEIR USE FOR THE PREVENTION OR TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND METABOLIC DISORDERS AND DISEASES Janssen Pharmaceutica, N.V. (BE) 2013-01-16 — — EP disclosed
US-20120329792-A1 IMIDAZO[1,2-a]PYRAZINE DERIVATIVES AND THEIR USE FOR THE PREVENTION OR TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND METABOLIC DISORDERS AND DISEASES JANSSEN PHARMACEUTICA NV 2012-12-27 — — US disclosed
WO-2011110545-A1 IMIDAZO [1, 2 -A] PYRAZINE DERIVATIVES AND THEIR USE FOR THE PREVENTION OR TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND METABOLIC DISORDERS AND DISEASES JANSSEN PHARMACEUTICA NV (BE) 2011-09-15 — — 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-20120329792-A1 IMIDAZO[1,2-a]PYRAZINE DERIVATIVES AND THEIR USE FOR THE PREVENTION OR TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND METABOLIC DISORDERS AND DISEASES PDE12, PDE10A, PDE5A PDE5A 3/4885PDE6A 22/4885PDE1B 10/4885

“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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