SCHEMBL6835624

SCHEMBL6835624

CC(C)(C)OC(=O)N1CCN(c2cccc(C#N)c2)C(C(=O)O)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
GPR119 Q8TDV5 9/20 0.46
USP30 Q70CQ3 1/20 0.43
CHRM4 P08173 1/20 0.42
MGLL Q99685 2/20 0.40
EGLN2 Q96KS0 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40

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
SCHEMBL7065084 0.86 GRM5 (0.49) NOTUMCHRM4MGLL
SCHEMBL4930885 0.84 STS (0.47) NOTUMGPR119USP30
SCHEMBL14026929 0.84 GPR119 (0.46) GPR119USP30
SCHEMBL21360375 0.84 GPR119 (0.55) GPR119USP30
SCHEMBL8236255 0.84 GPR119 (0.55) GPR119USP30
SCHEMBL14026913 0.84 USP30 (0.53) GPR119USP30
SCHEMBL3609661 0.82 USP30 (0.58) NOTUMGPR119USP30CHRM4MGLL
SCHEMBL688078 0.81 GPR119 (0.56) NOTUMGPR119CHRM4MGLLEGLN2
SCHEMBL18452908 0.79 HRH3 (0.48) NOTUMGPR119USP30
SCHEMBL20510393 0.78 GPR119 (0.50) NOTUMGPR119USP30CHRM4

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
CN-1496361-A Phenyl derivatives 3 Ĭ��ר���ɷ����޹�˾ 2004-05-12 CN disclosed
US-20040082563-A1 Phenyl derivatives 3 MERCK PATENT GMBH (DE) 2004-04-29 US disclosed
EP-1368341-A1 PHENYL DERIVATIVES 3 MERCK PATENT GmbH (DE) 2003-12-10 EP disclosed
WO-2002074765-A1 PHENYL DERIVATIVES 3 MERCK PATENT GMBH (DE) 2002-09-26 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-20040082563-A1 Phenyl derivatives 3 F2, F11, F12 NOTUM 3173/4885GPR119 2646/4885USP30 3843/4885

“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.