SCHEMBL19463138

SCHEMBL19463138

O=Cc1cccc(-c2cc(OC3COC3)cnn2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 1/20 0.35
▸ BRD4 O60885 1/20 0.34
▸ DYRK1A Q13627 2/20 0.33
▸ DYRK2 Q92630 2/20 0.33
▸ DYRK1B Q9Y463 2/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ MEF2D Q14814 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ AXL P30530 1/20 0.33
▸ PRKDC P78527 1/20 0.32
▸ TRIM24 O15164 1/20 0.32
▸ TRIM33 Q9UPN9 1/20 0.32
▸ GABRG2 P18507 4/20 0.32
▸ GABRB3 P28472 4/20 0.32
▸ GABRA5 P31644 4/20 0.32
▸ GABRA3 P34903 4/20 0.32
▸ GABRA1 P14867 3/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32

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
SCHEMBL17687823 0.84 DYRK1A (0.34) CDK8BRD4DYRK1ADYRK2DYRK1B
SCHEMBL19463373 0.82 CDK8 (0.38) CDK8BRD4DYRK1ADYRK2DYRK1B
SCHEMBL17687890 0.81 ADORA2A (0.40) BRD4DYRK1A
SCHEMBL17687913 0.81 ADORA2A (0.40) BRD4DYRK1A
SCHEMBL19471478 0.81 ADORA2A (0.40) BRD4DYRK1A
SCHEMBL19463827 0.80 KMO (0.35) KMOMTOR
SCHEMBL22528205 0.79 HDAC4 (0.42) CDK8BRD4HDAC4MEF2DPRKDC
SCHEMBL16180162 0.78 NPC1 (0.42) CDK8BRD4DYRK1ADYRK2DYRK1B
SCHEMBL17687811 0.78 SCD5 (0.39) TRIM24TRIM33GABRG2GABRB3GABRA5
SCHEMBL17687808 0.78 SCD5 (0.39) TRIM24TRIM33GABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200325154-A1 ANTIBACTERIAL BIAROMATIC DERIVATIVES WITH OXETANE-3-YLOXY SUBSTITUTION ACTELION PHARMACEUTICALS LTD (CH) 2020-10-15 — — US disclosed
EP-3442970-A1 ANTIBACTERIAL BIAROMATIC DERIVATIVES WITH OXETANE-3-YLOXY SUBSTITUTION Idorsia Pharmaceuticals Ltd (CH) 2019-02-20 — — EP disclosed
WO-2017179002-A1 ANTIBACTERIAL BIAROMATIC DERIVATIVES WITH OXETANE-3-YLOXY SUBSTITUTION ACTELION PHARMACEUTICALS LTD (CH) 2017-10-19 — — 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-20200325154-A1 ANTIBACTERIAL BIAROMATIC DERIVATIVES WITH OXETANE-3-YLOXY SUBSTITUTION MT-CO3, UQCRC1, MT-ND3 CDK8 3978/4885BRD4 1716/4885DYRK1A 3955/4885

“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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