SCHEMBL4121472

SCHEMBL4121472

CN1CCCn2c(-c3cc(Cl)c(F)cc3F)nc(C(=O)NC(C(=O)N3CCOCC3)C(C)(C)C)c2C1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.52
STAT6 P42226 1/20 0.35
ALPL P05186 1/20 0.33
PDE4B Q07343 6/20 0.32
PDE4D Q08499 5/20 0.32
CCR1 P32246 2/20 0.32
CNR1 P21554 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDE4A P27815 5/20 0.31
PDE4C Q08493 5/20 0.31
ALDH1A1 P00352 1/20 0.31
AVPR1B P47901 1/20 0.31
MAP3K14 Q99558 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
TACR1 P25103 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
SCHEMBL4121468 1.00 CNR2 (0.52) CNR2STAT6ALPLPDE4BPDE4D
SCHEMBL4109706 0.94 CNR2 (0.51) CNR2STAT6CCR1SMN1; SMN2ALDH1A1
SCHEMBL4109702 0.94 CNR2 (0.51) CNR2STAT6CCR1SMN1; SMN2ALDH1A1
SCHEMBL4128350 0.94 CNR2 (0.56) CNR2STAT6PDE4BPDE4DCCR1
SCHEMBL4128344 0.94 CNR2 (0.56) CNR2STAT6PDE4BPDE4DCCR1
SCHEMBL4117052 0.94 CNR2 (0.55) CNR2STAT6CNR1ALDH1A1MAP3K14
SCHEMBL4117055 0.94 CNR2 (0.55) CNR2STAT6CNR1ALDH1A1MAP3K14
SCHEMBL4115433 0.91 CNR2 (0.54) CNR2STAT6CCR1CNR1SMN1; SMN2
SCHEMBL4115431 0.91 CNR2 (0.54) CNR2STAT6CCR1CNR1SMN1; SMN2
SCHEMBL4117103 0.90 CNR2 (0.53) CNR2STAT6PDE4BPDE4DCCR1

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 588/4885ALPL 3558/4885

“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.