SCHEMBL1824940

SCHEMBL1824940

COCCc1ccc(-c2c(C(F)(F)F)nc3c(N4CCOCC4)ccnn23)cn1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 10/20 0.77
PDE2A O00408 1/20 0.77
PDE8A O60658 1/20 0.77
PDE5A O76074 1/20 0.77
PDE9A O76083 1/20 0.77
PDE6A P16499 1/20 0.77
HTR2C P28335 1/20 0.77
HTR7 P34969 1/20 0.77
HTR2B P41595 1/20 0.77
PDE1B Q01064 1/20 0.77
PDE4D Q08499 1/20 0.77
PDE7A Q13946 1/20 0.77
PDE3A Q14432 1/20 0.77
PDE11A Q9HCR9 1/20 0.77

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 0.87 PDE10A (1.00) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL2586336 0.86 PDE10A (0.98) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL1827550 0.86 PDE10A (0.98) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1824412 0.86 PDE10A (0.81) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1825920 0.84 PDE10A (0.77) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL2585685 0.83 PDE10A (0.91) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL1828319 0.82 PDE10A (0.89) PDE10APDE2APDE8APDE5APDE9A
SCHEMBL2482955 0.81
SCHEMBL2583509 0.81 PDE10A (0.51) PDE10APDE2APDE8APDE5APDE9A
Jnj-42396302 SCHEMBL1824260 0.80 PDE10A (0.85) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2493889-B1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-09-06 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-2493889-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2012-09-05 EP disclosed
US-20120220581-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS JANSSEN-CILAG, S.A. (ES) 2012-08-30 US disclosed
US-20110269752-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS PASTOR-FERNANDEZ JOAQUIN 2011-11-03 US disclosed
WO-2011051342-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2011-05-05 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 (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-20120220581-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AND THEIR USE AS PDE10 INHIBITORS PDE12, PDE10A, PDE5A PDE10A 2/4885PDE2A 4/4885PDE8A 19/4885
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.