SCHEMBL20601412

SCHEMBL20601412

COc1ccc(C(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.59
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
FAAH O00519 1/20 0.46
MMP13 P45452 1/20 0.46
PIK3CD O00329 1/20 0.45
GLS O94925 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL9980757 0.83 GPR119 (0.62) GPR119MMP13PIK3CD
SCHEMBL22387770 0.82 GPR119 (0.56) GPR119KDM4EPKMFAAHMMP13
SCHEMBL12892153 0.80 GPR119 (0.52) GPR119KDM4EPKMPDE4APDE4B
SCHEMBL18025936 0.80 GPR119 (0.53) GPR119KDM4EPKMFAAHMMP13
SCHEMBL15537093 0.79 KMT2A (0.58) GPR119KDM4EPKMGLSALDH1A1
SCHEMBL20601445 0.79 KDM4E (0.68) GPR119KDM4EPKM
SCHEMBL8345325 0.79 GPR119 (0.51) GPR119KDM4EPKMPDE4APDE4B
SCHEMBL7400403 0.79 GPR119 (0.51) GPR119KDM4EPKMFAAH
SCHEMBL17942413 0.79 GPR119 (0.56) GPR119MMP13
SCHEMBL29529639 0.79 GPR119 (0.56) GPR119MMP13

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210078988-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-03-18 US disclosed
US-20210078988-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-03-18 US disclosed
EP-3645519-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-05-06 EP disclosed
CN-110770222-A Modulators of indoleamine2, 3-dioxygenase 葛兰素史克知识产权开发有限公司 2020-02-07 CN disclosed
WO-2019003142-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-03 WO disclosed
WO-2019003142-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-03 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-20210078988-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, TPH1 GPR119 41/4885KDM4E 657/4885PKM 892/4885

“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.