SCHEMBL19687626

SCHEMBL19687626

CCCCCCC(C)(C)c1ccc(C)nc1C

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.42
CNR1 P21554 15/20 0.38
SSTR4 P31391 1/20 0.36
KCNH2 Q12809 1/20 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
SCHEMBL21207640 0.93 SSTR4 (0.38) CNR2CNR1SSTR4
SCHEMBL22547851 0.85 SSTR4 (0.35) CNR2CNR1SSTR4KCNH2
SCHEMBL20997665 0.84 SSTR4 (0.35) CNR2CNR1SSTR4KCNH2
SCHEMBL19687547 0.84 SSTR4 (0.35) CNR2CNR1SSTR4KCNH2
SCHEMBL26076103 0.78 SSTR4 (0.38) SSTR4
SCHEMBL20868830 0.75 CNR2 (0.42) CNR2CNR1
SCHEMBL8149736 0.74 CNR2 (0.49) CNR2CNR1
SCHEMBL11445241 0.72 CNR2 (0.46) CNR2CNR1
SCHEMBL21207590 0.72 CNR2 (0.41) CNR2CNR1SSTR4
SCHEMBL24198884 0.71 NR5A1 (0.34) CNR2

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-10220036-B2 Triazolopyrimidine compounds and uses thereof NOVARTIS AG (CH) 2019-03-05 US disclosed
US-20170348312-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC. 2017-12-07 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-10220036-B2 Triazolopyrimidine compounds and uses thereof EZH2, DOT1L, EED CNR2 4319/4885CNR1 4051/4885SSTR4 4060/4885
US-20170348312-A1 TRIAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF EZH2, DOT1L, EED CNR2 4319/4885CNR1 4051/4885SSTR4 4060/4885

“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.