SCHEMBL4117186

SCHEMBL4117186

CN1CCCn2c(-c3cc(Cl)c(F)cc3F)nc(C(=O)N[C@H](CO)C(C)(C)C)c2C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.48
DGAT2 Q96PD7 1/20 0.35
PDE4B Q07343 4/20 0.34
PDE4D Q08499 3/20 0.34
JAK2 O60674 2/20 0.34
NTRK1 P04629 2/20 0.34
PDE4A P27815 3/20 0.33
PDE4C Q08493 3/20 0.33
LMNA P02545 2/20 0.32
SLC10A1 Q14973 2/20 0.32
TP53 P04637 3/20 0.32
MAPK1 P28482 3/20 0.32
THRB P10828 1/20 0.31

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
SCHEMBL4117191 1.00 CNR2 (0.48) CNR2DGAT2PDE4BPDE4DJAK2
SCHEMBL4108079 0.93 CNR2 (0.51) CNR2DGAT2JAK2NTRK1
SCHEMBL4108077 0.93 CNR2 (0.51) CNR2DGAT2JAK2NTRK1
SCHEMBL4113822 0.93 CNR2 (0.51) CNR2DGAT2JAK2NTRK1
SCHEMBL1175131 0.86 CNR2 (0.54) CNR2PDE4BPDE4DPDE4APDE4C
SCHEMBL1175128 0.86 CNR2 (0.54) CNR2PDE4BPDE4DPDE4APDE4C
SCHEMBL1175010 0.85 CNR2 (0.68) CNR2PDE4BPDE4DPDE4APDE4C
SCHEMBL4128344 0.85 CNR2 (0.56) CNR2PDE4BPDE4DPDE4APDE4C
SCHEMBL1175013 0.85 CNR2 (0.68) CNR2PDE4BPDE4DPDE4APDE4C
SCHEMBL4128350 0.85 CNR2 (0.56) CNR2PDE4BPDE4DPDE4APDE4C

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 6 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-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 2/4885DGAT2 1913/4885PDE4B 3700/4885

“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.