SCHEMBL20601472

SCHEMBL20601472

CC(=O)N1CCC(CC(NC(=O)c2ccc(Cl)cc2)c2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ UTS2R Q9UKP6 11/20 0.50
▸ ITGB3 P05106 1/20 0.50
▸ ITGA2B P08514 1/20 0.50
▸ CCR1 P32246 6/20 0.49
▸ KCNH2 Q12809 1/20 0.47

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
SCHEMBL20601295 0.91 KDM4E (0.58) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20601297 0.91 KDM4E (0.58) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20618746 0.89 KDM4E (0.54) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20618552 0.89 KDM4E (0.58) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20601301 0.89 KDM4E (0.53) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20601405 0.88 KDM4E (0.52) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20618744 0.88 KDM4E (0.55) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20601294 0.88 ITGB3 (0.56) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20618556 0.88 KDM4E (0.55) KDM4EGAAUTS2RITGB3ITGA2B
SCHEMBL20601224 0.87 UTS2R (0.55) KDM4EGAAUTS2RITGB3ITGA2B

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 5 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
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 KDM4E 657/4885GAA 462/4885UTS2R 1671/4885

“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.

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