SCHEMBL14764396

SCHEMBL14764396

Cc1cccc(Cl)c1-c1nnc2c(C)nc3ncccc3n12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 19/20 1.00
PDE10A Q9Y233 13/20 0.53
KDM4E B2RXH2 1/20 0.43
PDE4D Q08499 2/20 0.42
PDE11A Q9HCR9 1/20 0.42
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
PDE6H Q13956 1/20 0.41

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
SCHEMBL14764543 0.99 PDE2A (0.98) PDE2APDE10AKDM4EPDE4DPDE11A
SCHEMBL14764772 0.94 PDE2A (0.88) PDE2APDE10AKDM4EPDE4DPDE11A
SCHEMBL14764289 0.91 PDE2A (0.83) PDE2APDE10APDE4DPDE6DPDE6A
SCHEMBL14764467 0.81 PDE2A (0.70) PDE2APDE10A
SCHEMBL14764364 0.78 PDE2A (0.64) PDE2APDE10A
SCHEMBL15961858 0.77 PDE2A (1.00) PDE2APDE10AKDM4EPDE4DPDE11A
SCHEMBL15961862 0.77 PDE2A (0.62) PDE2APDE10APDE4DPDE11APDE4A
SCHEMBL14765049 0.76 PDE2A (0.64) PDE2APDE10AKDM4EPDE4DPDE6D
SCHEMBL14764577 0.74 PDE2A (0.74) PDE2APDE10A
SCHEMBL15953391 0.72 PDE2A (0.56) PDE2APDE10APDE4DPDE6DPDE6A

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 10 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
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 476/4885KDM4E 1145/4885

“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.