SCHEMBL16089604

SCHEMBL16089604

Cn1nc(-c2cncnc2)c2c1CNCC2

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SOD3 P08294 1/20 0.33
▸ CREBBP Q92793 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR7 P34969 1/20 0.32
▸ P2RX7 Q99572 1/20 0.32

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
Hydrochloric Acid SCHEMBL16035465 0.99 SOD3 (0.35) SOD3CREBBPHTR1AHTR2AHTR7
SCHEMBL16089603 0.83 P2RX7 (0.47) CREBBPP2RX7
Hydrochloric Acid SCHEMBL16036462 0.82 P2RX7 (0.46) CREBBPP2RX7
SCHEMBL16089630 0.78 — —
Hydrochloric Acid SCHEMBL16036233 0.77 — —
SCHEMBL16089631 0.77 P2RX7 (0.39) HTR2AHTR7P2RX7
Hydrochloric Acid SCHEMBL16036430 0.75 P2RX7 (0.38) SOD3HTR2AHTR7P2RX7
Hydrochloric Acid SCHEMBL31163291 0.74 HTR2A (0.46) HTR2A
SCHEMBL16200125 0.72 HTR7 (0.38) HTR7
SCHEMBL16088518 0.71 SOD3 (0.36) SOD3HTR2A

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820770-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-11820770-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-20220213095-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-07-07 — — US disclosed
US-11225478-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2022-01-18 — — US disclosed
US-20200325138-A1 P2X7 Modulators JANSSEN PHARMACEUTICA NV (BE) 2020-10-15 — — US disclosed
US-10703749-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2020-07-07 — — US disclosed
EP-3495365-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 — — EP disclosed
US-20190092770-A1 P2X7 Modulators JANSSEN PHARMACEUTICA NV (BE) 2019-03-28 — — US disclosed
EP-2970267-B3 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-30 — — EP disclosed
EP-3239151-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2017-11-01 — — EP disclosed
US-9464084-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2016-10-11 — — US disclosed
US-9464084-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2016-10-11 — — US disclosed
US-20160039809-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2016-02-11 — — US disclosed
US-20160039809-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2016-02-11 — — US disclosed
US-20150322062-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-11-12 — — US disclosed
US-20150322062-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-11-12 — — US disclosed
US-9066946-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2015-06-30 — — US disclosed
US-9066946-B2 P2X7 modulators JANSSEN PHARMACEUTICA NV (BE) 2015-06-30 — — US disclosed
US-20140275015-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-09-18 — — US disclosed
US-20140275015-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-09-18 — — 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 (9 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-20200325138-A1 P2X7 Modulators P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-20190092770-A1 P2X7 Modulators P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-11225478-B2 P2X7 modulators P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-20160039809-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RX5 SOD3 4439/4885CREBBP 2668/4885HTR1A 163/4885
US-20150322062-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-11820770-B2 P2X7 modulators P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-20220213095-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-10703749-B2 P2X7 modulators P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885
US-20140275015-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RY2 SOD3 4403/4885CREBBP 2428/4885HTR1A 210/4885

“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.

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