Jnj-42396302

Jnj-42396302

SCHEMBL2585685

COCCc1ccc(-c2c(C)nc3c(N4CCOCC4)ccnn23)cn1.O=P(O)(O)O

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Jnj-42396302. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.91
PDE2A O00408 1/20 0.91
PDE8A O60658 1/20 0.91
PDE5A O76074 1/20 0.91
PDE9A O76083 1/20 0.91
PDE6A P16499 1/20 0.91
HTR2C P28335 1/20 0.91
HTR7 P34969 1/20 0.91
HTR2B P41595 1/20 0.91
PDE1B Q01064 1/20 0.91
PDE4D Q08499 1/20 0.91
PDE7A Q13946 1/20 0.91
PDE3A Q14432 1/20 0.91
PDE11A Q9HCR9 1/20 0.91

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
Jnj-42396302 SCHEMBL1824885 0.95 PDE10A (1.00) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL1827550 0.95 PDE10A (0.98) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL2586336 0.95 PDE10A (0.98) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL1824260 0.92 PDE10A (0.85) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL1824259 0.92 PDE10A (0.85) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1828319 0.90 PDE10A (0.89) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1821902 0.86 PDE10A (0.83) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1825516 0.86 PDE10A (0.81) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1824412 0.85 PDE10A (0.81) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1824053 0.83 PDE10A (0.78) PDE10APDE2APDE8APDE5APDE9A

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
US-8716282-B2 Imidazo[1,2-b]pyridazine derivatives and their use as PDE10 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2014-05-06 US claimed
US-20110269752-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS PASTOR-FERNANDEZ JOAQUIN 2011-11-03 US claimed
EP-2702062-B1 SALT OF AN INHIBITOR OF PHOSPHODIESTERASE 10 ENZYME JANSSEN PHARMACEUTICA NV (BE) 2015-12-16 EP disclosed
US-8716282-B2 Imidazo[1,2-b]pyridazine derivatives and their use as PDE10 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2014-05-06 US disclosed
EP-2702062-A1 SALT OF AN INHIBITOR OF PHOSPHODIESTERASE 10 ENZYME Janssen Pharmaceutica, N.V. (BE) 2014-03-05 EP disclosed
WO-2012146644-A1 SALT OF AN INHIBITOR OF PHOSPHODIESTERASE 10 ENZYME JANSSEN PHARMACEUTICA NV (BE) 2012-11-01 WO disclosed
US-20110269752-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS PASTOR-FERNANDEZ JOAQUIN 2011-11-03 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-20110269752-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS PDE12, PDE10A, PDE5A PDE10A 2/4885PDE2A 4/4885PDE8A 19/4885

“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.