SCHEMBL16089594

SCHEMBL16089594

CN1N=CC[C@@H]1C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 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
SCHEMBL22454130 1.00 RIPK1 (0.31) RIPK1
SCHEMBL17244863 1.00 RIPK1 (0.31) RIPK1
SCHEMBL13967287 0.74 — —
SCHEMBL18806997 0.69 — —
SCHEMBL25080563 0.65 — —
SCHEMBL25468125 0.62 — —
SCHEMBL22795970 0.56 RIPK1 (0.31) RIPK1
SCHEMBL5281962 0.54 — —
SCHEMBL24448925 0.54 — —
SCHEMBL17738289 0.54 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160376271-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV 2016-12-29 — — US disclosed
US-20160039809-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2016-02-11 — — 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20160376271-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RY2 RIPK1 2241/4885
US-20160039809-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RX5 RIPK1 2393/4885
US-20140275015-A1 P2X7 MODULATORS P2RX2, P2RX7, P2RY2 RIPK1 2241/4885

“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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