SCHEMBL4121463

SCHEMBL4121463

CCNC(=O)C(NC(=O)c1nc(-c2cc(F)c(F)cc2F)n2c1CN(C)CCC2)C(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.59
TP53 P04637 2/20 0.33
THRB P10828 2/20 0.33
BLM P54132 1/20 0.33
MAP3K14 Q99558 3/20 0.32
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
CNR1 P21554 1/20 0.31
PDE4D Q08499 1/20 0.31
MTNR1A P48039 1/20 0.30
MTNR1B P49286 1/20 0.30
GPR119 Q8TDV5 1/20 0.30
LMNA P02545 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
SCHEMBL4121460 1.00 CNR2 (0.59) CNR2TP53THRBBLMMAP3K14
SCHEMBL4117277 0.93 CNR2 (0.56) CNR2TP53THRBBLMMAP3K14
SCHEMBL4117281 0.93 CNR2 (0.56) CNR2TP53THRBBLMMAP3K14
SCHEMBL4116082 0.91 CNR2 (0.57) CNR2TP53THRBBLMMAP3K14
SCHEMBL4121072 0.91 CNR2 (0.57) CNR2TP53THRBBLMMAP3K14
SCHEMBL4121076 0.91 CNR2 (0.57) CNR2TP53THRBBLMMAP3K14
SCHEMBL4116087 0.91 CNR2 (0.57) CNR2TP53THRBBLMMAP3K14
SCHEMBL4109957 0.91 CNR2 (0.55) CNR2TP53THRBBLMMAP3K14
SCHEMBL4109953 0.91 CNR2 (0.55) CNR2TP53THRBBLMMAP3K14
SCHEMBL4127688 0.91 CNR2 (0.59) CNR2TP53THRBBLMCNR1

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 2/4885TP53 4585/4885THRB 1718/4885

“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.