SCHEMBL16990363

SCHEMBL16990363

O=c1[nH]c2cc(-c3cn(S(=O)(=O)c4ccccc4)c4cc(F)ccc34)cnc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK4 O00444 1/20 0.48
▸ CHEK1 O14757 1/20 0.48
▸ PRKD3 O94806 1/20 0.48
▸ MAP4K4 O95819 1/20 0.48
▸ CDK1 P06493 1/20 0.48
▸ LYN P07948 1/20 0.48
▸ RET P07949 1/20 0.48
▸ PIM1 P11309 1/20 0.48
▸ FER P16591 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ MARK3 P27448 1/20 0.48
▸ FLT4 P35916 1/20 0.48
▸ KDR P35968 1/20 0.48
▸ FLT3 P36888 1/20 0.48
▸ SYK P43405 1/20 0.48
▸ GSK3A P49840 1/20 0.48
▸ GSK3B P49841 1/20 0.48
▸ BLK P51451 1/20 0.48
▸ RPS6KA3 P51812 1/20 0.48
▸ LIMK1 P53667 1/20 0.48

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
SCHEMBL17097054 0.86 HTR6 (0.48) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990430 0.83 HTR6 (0.43) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990286 0.79 HTR6 (0.49) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990273 0.78 HTR6 (0.51) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990401 0.78 HTR6 (0.48) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990238 0.77 HTR6 (0.50) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990265 0.77 HTR6 (0.50) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16697491 0.77 HTR6 (0.50) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL16990259 0.77 HTR6 (0.50) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL17097303 0.77 HTR6 (0.46) PRKD3MAP4K4PIM1CDK5AURKB

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-9758505-B2 3-(indol-3-yl)-pyridine derivatives, pharmaceutical compositions and methods for use ITEOS THERAPEUTICS (BE) 2017-09-12 — — US disclosed
US-9758505-B2 3-(indol-3-yl)-pyridine derivatives, pharmaceutical compositions and methods for use ITEOS THERAPEUTICS (BE) 2017-09-12 — — US disclosed
EP-3105225-A1 NOVEL 3-(INDOL-3-YL)-PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE iTeos Therapeutics (BE) 2016-12-21 — — EP disclosed
WO-2015121812-A1 NOVEL 3-(INDOL-3-YL)-PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE ITEOS THERAPEUTICS (BE) 2015-08-20 — — WO disclosed
US-20150225367-A1 NOVEL 3-(INDOL-3-YL)-PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE ITEOS THERAPEUTICS (BE) 2015-08-13 — — US disclosed
US-20150225367-A1 NOVEL 3-(INDOL-3-YL)-PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE ITEOS THERAPEUTICS (BE) 2015-08-13 — — 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-20150225367-A1 NOVEL 3-(INDOL-3-YL)-PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE TDO2, IDO1, IDO2 PLK4 1375/4885CHEK1 2912/4885PRKD3 2113/4885

“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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