SCHEMBL20601141

SCHEMBL20601141

Cc1nccc(OC(=O)N2CCC(C(CC(C)C)NC(=O)c3ccc(Cl)cc3)CC2)c1C

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 16/20 0.50
CCR1 P32246 3/20 0.45
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP3A4 P08684 3/20 0.42

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
SCHEMBL20600948 0.91 IDO1 (0.40) IDO1CCR1CYP3A4
SCHEMBL20601136 0.90 IDO1 (0.49) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20600950 0.90 IDO1 (0.49) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20600915 0.89 IDO1 (0.47) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20600892 0.87 IDO1 (0.49) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20601003 0.85 CCR1 (0.46) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20600991 0.85 CCR1 (0.46) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20601127 0.85 IDO1 (0.49) IDO1CCR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20601058 0.85 IDO1 (0.41) IDO1CCR1ALDH1A1CYP3A4
SCHEMBL20600998 0.85 IDO1 (0.42) IDO1CCR1ALDH1A1CYP3A4

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-10927078-B2 Modulators of indoleamine 2,3-dioxygenase GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-02-23 US disclosed
US-20200165201-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-05-28 US disclosed
EP-3645520-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-05-06 EP disclosed
WO-2019003141-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-03 WO disclosed
WO-2019003141-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 (2 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-20200165201-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, TPH1 IDO1 1/4885CCR1 1565/4885KDM4E 657/4885
US-10927078-B2 Modulators of indoleamine 2,3-dioxygenase IDO1, IDO2, TPH1 IDO1 1/4885CCR1 1565/4885KDM4E 657/4885

“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.