SCHEMBL981820

SCHEMBL981820

CC(Oc1ccc(C2=CCN(S(C)(=O)=O)CC2)cc1)C1CCN(CC(C)(C)F)CC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGDR Q13258 1/20 0.39
ENPP2 Q13822 2/20 0.39
CCNT1 O60563 11/20 0.38
CDK9 P50750 11/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR119 Q8TDV5 2/20 0.36
THRB P10828 1/20 0.35
SYK P43405 1/20 0.34
TDO2 P48775 1/20 0.34

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
SCHEMBL10040265 0.92 PTGDR (0.40) PTGDRENPP2CCNT1CDK9LMNA
SCHEMBL977156 0.85 GPR119 (0.51) PTGDRENPP2CCNT1CDK9LMNA
SCHEMBL979908 0.83 CCNT1 (0.39) ENPP2CCNT1CDK9LMNAGPR119
SCHEMBL978848 0.81 CCNT1 (0.42) PTGDRCCNT1CDK9LMNAGPR119
SCHEMBL978157 0.80 GPR119 (0.51) GPR119
SCHEMBL980833 0.78 CCNT1 (0.39) ENPP2CCNT1CDK9LMNAGPR119
SCHEMBL979909 0.77 CCNT1 (0.37) PTGDRENPP2CCNT1CDK9LMNA
SCHEMBL980834 0.76 CCNT1 (0.37) PTGDRENPP2CCNT1CDK9LMNA
SCHEMBL980912 0.75 CCNT1 (0.46) CCNT1CDK9LMNAHPGDGPR119
SCHEMBL10040264 0.75 CCNT1 (0.40) CCNT1CDK9GPR119SYK

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 7 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-8207344-B2 GPR119 agonists ELI LILLY AND COMPANY (US) 2012-06-26 US disclosed
US-8207344-B2 GPR119 agonists ELI LILLY AND COMPANY (US) 2012-06-26 US disclosed
WO-2011008663-A1 GPR119 AGONISTS ELI LILLY AND COMPANY (US) 2011-01-20 WO disclosed
US-20110015199-A1 GPR119 Agonists ELI LILLY AND COMPANY (US) 2011-01-20 US disclosed
US-20110015199-A1 GPR119 Agonists ELI LILLY AND COMPANY (US) 2011-01-20 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 PTGDR 130/4885ENPP2 492/4885CCNT1 4475/4885

“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.