SCHEMBL10040264

SCHEMBL10040264

CC(C)(C)CN1CCC(COc2ccc(C3=CCN(S(C)(=O)=O)CC3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 2/20 0.40
CDK9 P50750 2/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
GPR119 Q8TDV5 1/20 0.37
MMP13 P45452 1/20 0.37
SYK P43405 1/20 0.37

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
SCHEMBL980833 0.92 CCNT1 (0.39) CCNT1CDK9CYP4F2CYP4A11GPR119
SCHEMBL979908 0.92 CCNT1 (0.39) CCNT1CDK9CYP4F2CYP4A11GPR119
SCHEMBL1048473 0.89 CCNT1 (0.37) CCNT1CDK9CYP4F2CYP4A11GPR119
SCHEMBL10040266 0.89 CCNT1 (0.41) CCNT1CDK9CYP4F2CYP4A11
SCHEMBL980281 0.83 TDP1 (0.48) CCNT1CDK9CYP4F2CYP4A11SYK
SCHEMBL10040265 0.83 PTGDR (0.40) CCNT1CDK9GPR119MMP13SYK
SCHEMBL982440 0.83 GPR119 (0.54) CCNT1CDK9CYP4F2CYP4A11GPR119
SCHEMBL977871 0.82 GPR119 (0.53) GPR119MMP13
SCHEMBL979246 0.82 GPR119 (0.40) CCNT1CDK9GPR119SYK
SCHEMBL979614 0.82 GPR119 (0.40) CCNT1CDK9CYP4F2CYP4A11GPR119

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-8207344-B2 GPR119 agonists ELI LILLY AND COMPANY (US) 2012-06-26 US disclosed
US-20110015199-A1 GPR119 Agonists ELI LILLY AND COMPANY (US) 2011-01-20 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-20110015199-A1 GPR119 Agonists GPR119, GLP1R, GCGR CCNT1 4475/4885CDK9 2128/4885CYP4F2 1001/4885

“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.