SCHEMBL20094345

SCHEMBL20094345

Cc1cc(C(F)(F)F)c(Cl)n2nc(C3CC3)nc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
PDE10A Q9Y233 9/20 0.35
HRH4 Q9H3N8 1/20 0.34
PDE4D Q08499 3/20 0.34
PDE4A P27815 2/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
HTT P42858 1/20 0.32
LRRK2 Q5S007 1/20 0.31
XPO1 O14980 2/20 0.31

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
SCHEMBL20094349 0.85 HRH4 (0.35) TSHRPDE10AHRH4PDE4DPDE4A
SCHEMBL20094276 0.83 PDE4A (0.36) PDE10AHRH4PDE4DPDE4APDE4B
SCHEMBL20088553 0.83 PDE4D (0.41) PDE10AHRH4PDE4DPDE4APDE4B
SCHEMBL20088561 0.80 PDE10A (0.38) PDE10AHRH4HTT
SCHEMBL20088555 0.79 KDM4E (0.36) PDE10AHTT
SCHEMBL20088556 0.78 HRH4 (0.34) PDE10AHRH4PDE4DPDE4APDE4B
SCHEMBL20094307 0.78 PDE10A (0.38) PDE10AHTT
SCHEMBL20088529 0.76 HRH4 (0.36) TSHRPDE10AHRH4PDE4DPDE4A
SCHEMBL20088546 0.76 PDE10A (0.42) PDE10A
SCHEMBL19560768 0.76 PDE10A (0.51) PDE10AHRH4PDE4DPDE4APDE4B

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
CN-109963851-B Fused bicyclic pyridine compounds and their use as AMPA receptor modulators 詹森药业有限公司 2021-11-30 CN disclosed
EP-3532477-B1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-08-26 EP disclosed
EP-3532477-B1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-08-26 EP disclosed
US-10087185-B2 Fused bicylic pyridine compounds and their use as AMPA receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2018-10-02 US disclosed
WO-2018080917-A1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed
US-20180111933-A1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-04-26 US disclosed
US-20180111933-A1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-04-26 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 (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-10087185-B2 Fused bicylic pyridine compounds and their use as AMPA receptor modulators GRIN1, GRIN3A, GRM1 TSHR 721/4885PDE10A 1518/4885HRH4 291/4885
US-20180111933-A1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS GRIN1, GRIN3A, GRM1 TSHR 721/4885PDE10A 1518/4885HRH4 291/4885

“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.