SCHEMBL17757917

SCHEMBL17757917

CN1CCC2(CC1)Nc1cc(Cl)c(Cl)cc1N=C2NCc1nccn1C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE7B Q9NP56 1/20 0.36
▸ EGLN1 Q9GZT9 1/20 0.34
▸ EGLN3 Q9H6Z9 1/20 0.34
▸ TRPM5 Q9NZQ8 2/20 0.33

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
SCHEMBL17757664 0.82 TAAR1 (0.33) —
SCHEMBL17757660 0.82 VNN1 (0.38) —
SCHEMBL17757923 0.82 SMN1; SMN2 (0.37) —
SCHEMBL17757659 0.82 CCNT1 (0.40) —
SCHEMBL17757926 0.81 PDE7B (0.34) PDE7B
SCHEMBL17757662 0.81 HRH4 (0.40) —
SCHEMBL17757675 0.81 — —
SCHEMBL17757502 0.81 CCNT1 (0.38) —
SCHEMBL17757143 0.80 MAPK7 (0.34) —
SCHEMBL17757671 0.80 GRM2 (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647687-B2 Spiropyrazine derivatives as inhibitors of non-apoptotic regulated cell-death HELMHOLTZ ZENTRUM MÜNCHEN DEUTSCHES FORSCHUNGSZENTRUM FÜR GESUNDHEIT UND UMWELT (GMBH) (DE) 2020-05-12 — — US disclosed
WO-2016075137-A1 SPIROPYRAZINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2016-05-19 — — 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 (1 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-10647687-B2 Spiropyrazine derivatives as inhibitors of non-apoptotic regulated cell-death AIFM2, BAD, AIFM1 PDE7B 3724/4885EGLN1 2442/4885EGLN3 2288/4885

“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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