SCHEMBL4122259

SCHEMBL4122259

Cc1noc([C@@H](NC(=O)c2nc(-c3cc(F)c(F)cc3F)n3c2CNCCC3)C(C)(C)C)n1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.35
RIPK1 Q13546 1/20 0.31
RPS6KA3 P51812 3/20 0.31
RPS6KA2 Q15349 1/20 0.30

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
SCHEMBL4122263 1.00 CNR2 (0.35) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL1174993 0.91 CNR2 (0.36) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL4121083 0.91 CNR2 (0.37) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL4121091 0.91 CNR2 (0.37) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL1174989 0.91 CNR2 (0.36) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL4117922 0.89 CNR2 (0.36) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL4117926 0.89 CNR2 (0.36) CNR2RIPK1RPS6KA3RPS6KA2
SCHEMBL4122075 0.87 CNR2 (0.47) CNR2RIPK1
SCHEMBL4122082 0.87 CNR2 (0.47) CNR2RIPK1
SCHEMBL1174150 0.85 CNR2 (0.46) CNR2RIPK1RPS6KA3RPS6KA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US claimed
US-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US disclosed
US-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US disclosed
US-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US disclosed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US disclosed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US disclosed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 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 (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-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CNR1, CNR2, TRPV1 CNR2 2/4885RIPK1 1721/4885RPS6KA3 1701/4885

“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.