SCHEMBL20548604

SCHEMBL20548604

O=c1onc(Cc2c(F)cccc2Cl)n1Cc1cccc(C(F)(F)F)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.39
C5AR1 P21730 1/20 0.39
NPC1 O15118 1/20 0.36
GLA P06280 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CMA1 P23946 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL30314568 1.00 P2RX7 (0.39) P2RX7C5AR1NPC1GLARAB9A
SCHEMBL30314141 0.93 C5AR1 (0.43) P2RX7C5AR1NPC1GLARAB9A
SCHEMBL20548469 0.93 C5AR1 (0.43) P2RX7C5AR1NPC1GLARAB9A
SCHEMBL20548552 0.92 MAPT (0.38) P2RX7C5AR1
SCHEMBL30314279 0.92 MAPT (0.38) P2RX7C5AR1
SCHEMBL20548435 0.89 NPC1 (0.40) NPC1GLARAB9AL3MBTL1MEN1
SCHEMBL30314537 0.89 NPC1 (0.40) NPC1GLARAB9AL3MBTL1MEN1
SCHEMBL20548655 0.86 KMT2A (0.47) NPC1GLARAB9AL3MBTL1MEN1
SCHEMBL20548650 0.86 L3MBTL1 (0.43) NPC1GLARAB9AL3MBTL1MEN1
SCHEMBL30314366 0.86 L3MBTL1 (0.43) NPC1GLARAB9AL3MBTL1MEN1

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-11623919-B2 Heterocyclic P2X7 antagonists BREYE THERAPEUTICS APS (DK) 2023-04-11 US claimed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US claimed
EP-3398941-A1 HETEROCYCLIC P2X7 ANTAGONISTS AXXAM S.p.A. (IT) 2018-11-07 EP claimed
US-11623919-B2 Heterocyclic P2X7 antagonists BREYE THERAPEUTICS APS (DK) 2023-04-11 US disclosed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US disclosed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US disclosed
EP-3398941-A1 HETEROCYCLIC P2X7 ANTAGONISTS AXXAM S.p.A. (IT) 2018-11-07 EP 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-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS P2RY1, P2RX1, P2RX3 P2RX7 4/4885C5AR1 224/4885NPC1 468/4885
US-11623919-B2 Heterocyclic P2X7 antagonists P2RY1, P2RX1, P2RX3 P2RX7 4/4885C5AR1 224/4885NPC1 468/4885

“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.