SCHEMBL19035702

SCHEMBL19035702

CN1CC=C(c2cnccn2)CC1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43

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
SCHEMBL82262 0.78 QDPR (0.45) QDPR
SCHEMBL8488039 0.77 SIGMAR1 (0.53) QDPR
SCHEMBL21037217 0.75 QDPR (0.42) QDPR
SCHEMBL23916223 0.74 QDPR (0.57) QDPR
SCHEMBL13490635 0.74 QDPR (0.45) QDPR
SCHEMBL27793790 0.74 NISCH (0.42)
SCHEMBL13490629 0.73 CCR1 (0.48) QDPR
SCHEMBL9422305 0.73 CHRM2 (0.55)
SCHEMBL31718158 0.73 QDPR (0.63) QDPR
SCHEMBL24783066 0.73 QDPR (0.42) QDPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10301267-B2 Compounds ASTRAZENECA AB (SE) 2019-05-28 US disclosed
US-20170260143-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2017-09-14 US disclosed
US-9688640-B2 Methods of treating cancer with a pyrazole derivative ASTRAZENECA AB (SE) 2017-06-27 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 (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-10301267-B2 Compounds SLC10A1, CYP11B1, ABCB11 QDPR 1501/4885PPARG 2845/4885PPARA 3620/4885
US-20170260143-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 QDPR 2508/4885PPARG 2957/4885PPARA 4088/4885

“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.