SCHEMBL14764289

SCHEMBL14764289

Cc1cccc(C)c1-c1nnc2c(C)nc3ncccc3n12

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 19/20 0.83
PDE10A Q9Y233 14/20 0.43
PDE6D O43924 1/20 0.41
PDE6A P16499 1/20 0.41
PDE6G P18545 1/20 0.41
PDE4A P27815 1/20 0.41
PDE6B P35913 1/20 0.41
PDE6C P51160 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PDE6H Q13956 1/20 0.41
BACE1 P56817 1/20 0.39

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
SCHEMBL14764396 0.91 PDE2A (1.00) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14764543 0.90 PDE2A (0.98) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14764772 0.86 PDE2A (0.88) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14764655 0.79 PDE2A (0.62) PDE2APDE10A
SCHEMBL14764364 0.78 PDE2A (0.64) PDE2APDE10A
SCHEMBL15961863 0.73 PDE2A (0.49) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14764467 0.71 PDE2A (0.70) PDE2APDE10A
SCHEMBL15953378 0.69 PDE2A (0.59) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL16053185 0.68 PDE2A (0.53) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL15961858 0.67 PDE2A (1.00) PDE2APDE10APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140235645-A1 Pyridine Compounds and Uses Thereof H. LUNDBECK A/S (DK) 2014-08-21 US claimed
EP-2763989-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. Lundbeck A/S (DK) 2014-08-13 EP claimed
WO-2013034761-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. LUNDBECK A/S (DK) 2013-03-14 WO claimed
US-9056863-B2 Substituted 2,3,5,9,9B-pentaazacyclopenta[a]naphthalenes and uses thereof H. LUNDBECK A/S (DK) 2015-06-16 US disclosed
US-9056863-B2 Substituted 2,3,5,9,9B-pentaazacyclopenta[a]naphthalenes and uses thereof H. LUNDBECK A/S (DK) 2015-06-16 US disclosed
US-9056863-B2 Substituted 2,3,5,9,9B-pentaazacyclopenta[a]naphthalenes and uses thereof H. LUNDBECK A/S (DK) 2015-06-16 US disclosed
US-20140235645-A1 Pyridine Compounds and Uses Thereof H. LUNDBECK A/S (DK) 2014-08-21 US disclosed
US-20140235645-A1 Pyridine Compounds and Uses Thereof H. LUNDBECK A/S (DK) 2014-08-21 US disclosed
US-20140235645-A1 Pyridine Compounds and Uses Thereof H. LUNDBECK A/S (DK) 2014-08-21 US disclosed
EP-2763989-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. Lundbeck A/S (DK) 2014-08-13 EP disclosed
WO-2013034761-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. LUNDBECK A/S (DK) 2013-03-14 WO disclosed
WO-2013034761-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. LUNDBECK A/S (DK) 2013-03-14 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-20140235645-A1 Pyridine Compounds and Uses Thereof ATP6V1B2, NDUFS5, MT-ND5 PDE2A 719/4885PDE10A 476/4885PDE6D 467/4885

“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.