SCHEMBL10090992

SCHEMBL10090992

CCNC(=O)[C@@H](NC(=O)c1nc(-c2ccc(F)c(F)c2)n2c1CCOCC2)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 17/20 0.43
CNR2 P34972 1/20 0.42
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL10091070 0.92 CNR2 (0.43) GRM2CNR2LMNATP53THRB
SCHEMBL10090983 0.92 GRM2 (0.42) GRM2CNR2LMNATP53THRB
SCHEMBL343705 0.91 CNR2 (0.52) GRM2CNR2
SCHEMBL343704 0.91 CNR2 (0.52) GRM2CNR2
SCHEMBL10090979 0.90 GRM2 (0.44) GRM2CNR2
SCHEMBL10091042 0.89 LMNA (0.49) CNR2LMNATP53THRB
SCHEMBL10090989 0.88 LMNA (0.51) CNR2LMNATP53THRB
SCHEMBL10091008 0.88 CNR2 (0.46) CNR2LMNATP53THRB
SCHEMBL10090985 0.88 GRM2 (0.42) GRM2CNR2
SCHEMBL13292581 0.87 GRM2 (0.43) GRM2CNR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835422-B2 Substituted imidazoheterocycle derivatives CARA THERAPEUTICS, INC. (US) 2014-09-16 US disclosed
US-8835422-B2 Substituted imidazoheterocycle derivatives CARA THERAPEUTICS, INC. (US) 2014-09-16 US disclosed
US-20120015930-A1 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2012-01-19 US disclosed
US-20120015930-A1 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2012-01-19 US disclosed
WO-2010068520-A2 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2010-06-17 WO 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-20120015930-A1 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CNR1, CNR2, HRH1 GRM2 564/4885CNR2 2/4885LMNA 4601/4885

“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.