SCHEMBL4119947

SCHEMBL4119947

CC(C)(C)C([NH])CNS(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.41
POLB P06746 1/20 0.31
PER2 O15055 1/20 0.30
CRY1 Q16526 1/20 0.30
CRY2 Q49AN0 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
SCHEMBL12203090 0.76 GRIA4 (0.43) GRIA4PER2CRY1CRY2
SCHEMBL12898950 0.74 GRIA4 (0.46) GRIA4PER2CRY1CRY2
SCHEMBL4119954 0.73 GRIA4 (0.41) GRIA4PER2CRY1CRY2
SCHEMBL12884417 0.73 GRIA4 (0.44) GRIA4PER2CRY1CRY2
SCHEMBL8282273 0.71 GRIA4 (0.40) GRIA4
SCHEMBL13690769 0.71 GRIA4 (0.40) GRIA4
SCHEMBL8270968 0.70 GRIA4 (0.39) GRIA4
SCHEMBL22457461 0.69 GRIA4 (0.40) GRIA4PER2CRY1CRY2
SCHEMBL8280603 0.68 GRIA4 (0.38) GRIA4
SCHEMBL91255 0.67

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 claimed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US claimed

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 GRIA4 557/4885POLB 3552/4885PER2 1612/4885

“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.