SCHEMBL1174867

SCHEMBL1174867

CNC(=O)C(NC(=O)c1nc(-c2ccc(C(F)(F)F)cc2F)n2c1CN(C)CCC2)C(C)(C)C

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.68
CNR1 P21554 6/20 0.43
PDE2A O00408 1/20 0.35
SLC6A9 P48067 1/20 0.34
TRPV4 Q9HBA0 1/20 0.34
RORC P51449 1/20 0.33
SYK P43405 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 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
SCHEMBL1174864 1.00 CNR2 (0.68) CNR2CNR1PDE2ASLC6A9TRPV4
SCHEMBL4117167 0.95 CNR2 (0.60) CNR2CNR1PDE2ATRPV4MMP2
SCHEMBL4117162 0.95 CNR2 (0.60) CNR2CNR1PDE2ATRPV4MMP2
SCHEMBL1174080 0.93 CNR2 (0.68) CNR2CNR1TRPV4SYK
SCHEMBL1174078 0.93 CNR2 (0.68) CNR2CNR1TRPV4SYK
SCHEMBL4126757 0.93 CNR2 (0.70) CNR2CNR1PDE2ASLC6A9TRPV4
SCHEMBL4126754 0.93 CNR2 (0.70) CNR2CNR1PDE2ASLC6A9TRPV4
SCHEMBL4127695 0.92 CNR2 (0.69) CNR2CNR1SLC6A9TRPV4MMP2
SCHEMBL4127699 0.92 CNR2 (0.69) CNR2CNR1SLC6A9TRPV4MMP2
SCHEMBL4108468 0.91 CNR2 (0.67) CNR2CNR1TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859538-B2 Uses of substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2014-10-14 US claimed
US-8859538-B2 Uses of substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2014-10-14 US disclosed
EP-2170350-B1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS INC (US) 2013-09-11 EP disclosed
US-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US disclosed
US-20110034443-A1 USES OF SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2011-02-10 US disclosed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US disclosed
US-7517874-B2 Substituted imidazo[1,5-a][1,4]diazepines and imidazo[1,5-a]pyrazines as cannabinoid receptor agonists for the treatment of pain CARA THERAPEUTICS, INC. (US) 2009-04-14 US disclosed
US-20080318935-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2008-12-25 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 (3 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 2/4885CNR1 1/4885PDE2A 3749/4885
US-20110034443-A1 USES OF SUBSTITUTED IMIDAZOHETEROCYCLES CNR2, CNR1, TRPV1 CNR2 1/4885CNR1 2/4885PDE2A 3818/4885
US-20080318935-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CNR1, CNR2, TRPV1 CNR2 2/4885CNR1 1/4885PDE2A 3749/4885

“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.