SCHEMBL4126662

SCHEMBL4126662

CN1CCCn2c(-c3ccc(F)c(F)c3)nc(C(=O)NC(C(=O)N3CCOCC3)C(C)(C)C)c2C1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.59
STAT6 P42226 1/20 0.39
GRM2 Q14416 7/20 0.35
LMNA P02545 2/20 0.34
TP53 P04637 2/20 0.34
THRB P10828 1/20 0.34
GRIN2B Q13224 1/20 0.34
WDR5 P61964 1/20 0.33
AVPR1B P47901 2/20 0.33
MAPT P10636 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
SCHEMBL4126659 1.00 CNR2 (0.59) CNR2STAT6GRM2LMNATP53
SCHEMBL4117055 0.89 CNR2 (0.55) CNR2STAT6
SCHEMBL4117052 0.89 CNR2 (0.55) CNR2STAT6
SCHEMBL4121009 0.89 CNR2 (0.55) CNR2STAT6TP53THRBGRIN2B
SCHEMBL4121804 0.89 CNR2 (0.59) CNR2STAT6LMNATP53THRB
SCHEMBL4121005 0.89 CNR2 (0.55) CNR2STAT6TP53THRBGRIN2B
SCHEMBL4121799 0.89 CNR2 (0.59) CNR2STAT6LMNATP53THRB
SCHEMBL4115433 0.88 CNR2 (0.54) CNR2STAT6LMNATP53THRB
SCHEMBL4115431 0.88 CNR2 (0.54) CNR2STAT6LMNATP53THRB
SCHEMBL10090988 0.88 CNR2 (0.45) CNR2STAT6GRM2LMNA

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-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

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 2/4885STAT6 588/4885GRM2 843/4885

“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.