SCHEMBL491858

SCHEMBL491858

O=C(NCC1(O)CCCCCC1)c1c(Cl)ccc2nc(N3CC[C@H](NCCO)C3)ccc12

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.71

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
SCHEMBL22878864 1.00 P2RX7 (0.71) P2RX7
Water SCHEMBL492139 0.99 P2RX7 (0.70) P2RX7
SCHEMBL491734 0.87 P2RX7 (0.60) P2RX7
SCHEMBL1802127 0.86 P2RX7 (0.82) P2RX7
SCHEMBL491653 0.85 P2RX7 (0.71) P2RX7
Hydrochloric Acid SCHEMBL3839613 0.85 P2RX7 (0.81) P2RX7
SCHEMBL17327671 0.84 P2RX7 (0.65) P2RX7
SCHEMBL17327643 0.83 P2RX7 (1.00) P2RX7
SCHEMBL4176834 0.83 P2RX7 (0.55) P2RX7
SCHEMBL3837373 0.82 P2RX7 (0.75) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11376272-B2 Methods of modulating immune activity FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2022-07-05 US disclosed
US-20210299155-A1 METHODS OF MODULATING IMMUNE ACTIVITY FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-30 US disclosed
EP-3402469-B1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) INST NAT SANTE RECH MED (FR) 2021-01-06 EP disclosed
US-10548980-B2 P2X7 receptor antagonists for restoring T-cell lymphopoiesis in subjects infected with human immunodeficiency virus (HIV) INSERM (Institut National de la Santé et de la Recherche Médicale (FR) 2020-02-04 US disclosed
US-20190022223-A1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) INSERM (INSTITUT NATIONAL DE LA SANTÉ ET LA SANTÉ ET DE LA RECHERCHE MÉDICALE) (FR) 2019-01-24 US disclosed
WO-2017121840-A1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2017-07-20 WO disclosed
US-8106073-B2 Quinoline derivatives 057 ASTRAZENECA AB (SE) 2012-01-31 US disclosed
US-8106073-B2 Quinoline derivatives 057 ASTRAZENECA AB (SE) 2012-01-31 US disclosed
US-8106073-B2 Quinoline derivatives 057 ASTRAZENECA AB (SE) 2012-01-31 US disclosed
EP-2225222-B1 A QUINOLINE DERIVATIVE ACTING AS A P2X7-RECEPTOR ANTAGONIST ASTRAZENECA AB (SE) 2011-09-14 EP disclosed
EP-2225222-B1 A QUINOLINE DERIVATIVE ACTING AS A P2X7-RECEPTOR ANTAGONIST ASTRAZENECA AB (SE) 2011-09-14 EP disclosed
US-20090143428-A1 Quinoline Derivatives 057 ASTRAZENECA AB (SE) 2009-06-04 US disclosed
US-20090143428-A1 Quinoline Derivatives 057 ASTRAZENECA AB (SE) 2009-06-04 US disclosed
US-20090143428-A1 Quinoline Derivatives 057 ASTRAZENECA AB (SE) 2009-06-04 US disclosed
WO-2009070116-A1 A QUINOLINE DERIVATIVE ACTING AS A P2X7-RECEPTOR ANTAGONIST ASTRAZENECA AB (SE) 2009-06-04 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 (5 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-11376272-B2 Methods of modulating immune activity STING1, IRF3, CGAS P2RX7 12/4885
US-10548980-B2 P2X7 receptor antagonists for restoring T-cell lymphopoiesis in subjects infected with human immunodeficiency virus (HIV) P2RX7, P2RX1, P2RX5 P2RX7 1/4885
US-20090143428-A1 Quinoline Derivatives 057 CYP3A7, UGT1A7, UGT2B7 P2RX7 64/4885
US-20210299155-A1 METHODS OF MODULATING IMMUNE ACTIVITY STING1, IRF3, CGAS P2RX7 14/4885
US-20190022223-A1 P2X7 RECEPTOR ANTAGONISTS FOR RESTORING T-CELL LYMPHOPOIESIS IN SUBJECTS INFECTED WITH HUMAN IMMUNODEFICIENCY VIRUS (HIV) P2RX7, P2RX1, P2RX5 P2RX7 1/4885

“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.