SCHEMBL978848

SCHEMBL978848

CC(Oc1ccc(C2=CCN(S(C)(=O)=O)CC2)cc1)C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 13/20 0.42
CDK9 P50750 13/20 0.42
PTGDR Q13258 1/20 0.41
TDO2 P48775 1/20 0.40
SYK P43405 1/20 0.37
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37
JAK2 O60674 1/20 0.37
JAK3 P52333 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
ALDH1A1 P00352 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL979615 0.84 CCNT1 (0.38) CCNT1CDK9PTGDRTDO2SYK
SCHEMBL982441 0.83 CCNT1 (0.37) CCNT1CDK9PTGDRTDO2SYK
SCHEMBL980834 0.83 CCNT1 (0.37) CCNT1CDK9PTGDRTDO2LMNA
SCHEMBL979909 0.83 CCNT1 (0.37) CCNT1CDK9PTGDRTDO2LMNA
SCHEMBL10040265 0.82 PTGDR (0.40) CCNT1CDK9PTGDRTDO2SYK
SCHEMBL9947615 0.82 CCNT1 (0.36) CCNT1CDK9PTGDRTDO2SYK
SCHEMBL9947643 0.82 CCNT1 (0.36) CCNT1CDK9PTGDRTDO2SYK
SCHEMBL981820 0.81 PTGDR (0.39) CCNT1CDK9PTGDRTDO2SYK
SCHEMBL980281 0.80 TDP1 (0.48) CCNT1CDK9TDO2SYK
SCHEMBL978157 0.80 GPR119 (0.51) GPR119

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 4 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
EP-2454251-A1 GPR119 AGONISTS Eli Lilly and Company (US) 2012-05-23 EP 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

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 2128/4885PTGDR 130/4885

“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.