SCHEMBL17687824

SCHEMBL17687824

CN1CC(Oc2cncc(-c3cncc(C=O)c3)n2)C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 5/20 0.38
▸ TLR7 Q9NYK1 1/20 0.33
▸ BACE1 P56817 2/20 0.32
▸ PIM2 Q9P1W9 2/20 0.31
▸ BRAF P15056 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ DYRK1A Q13627 3/20 0.31
▸ GSK3B P49841 2/20 0.31
▸ WNT1 P04628 1/20 0.31

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
SCHEMBL17687832 0.92 FFAR4 (0.42) FFAR4TLR7
SCHEMBL19471844 0.92 FFAR4 (0.42) FFAR4TLR7
SCHEMBL17688084 0.80 FFAR4 (0.36) FFAR4TLR7PIM2PIM1PIM3
SCHEMBL17687792 0.80 BTK (0.41) FFAR4PIM1
SCHEMBL17688042 0.79 DYRK1A (0.38) FFAR4TLR7BACE1PIM2PIM1
SCHEMBL17687787 0.78 TLR7 (0.34) FFAR4TLR7BACE1PIM2PIM1
SCHEMBL17687819 0.75 BTK (0.33) FFAR4BACE1PIM2PIM1PIM3
SCHEMBL19471678 0.74 FFAR4 (0.39) FFAR4TLR7PIM2PIM1PIM3
SCHEMBL17687807 0.74 FFAR4 (0.39) FFAR4TLR7PIM2PIM1PIM3
SCHEMBL17687826 0.73 SLC6A2 (0.41) FFAR4PIM2PIM1PIM3

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
EP-3207042-B1 ANTIBACTERIAL BASIC BIAROMATIC DERIVATIVES WITH AMINOALKOXY SUBSTITUTION IDORSIA PHARMACEUTICALS LTD (CH) 2018-10-03 — — EP disclosed
US-9850256-B2 Antibacterial basic biaromatic derivatives with aminoalkoxy substitution IDORSIA PHARMACEUTICALS LTD (CH) 2017-12-26 — — US disclosed
US-20170305927-A1 ANTIBACTERIAL BASIC BIAROMATIC DERIVATIVES WITH AMINOALKOXY SUBSTITUTION IDORSIA PHARMACEUTICALS LTD (CH) 2017-10-26 — — US disclosed
EP-3207042-A1 ANTIBACTERIAL BASIC BIAROMATIC DERIVATIVES WITH AMINOALKOXY SUBSTITUTION Idorsia Pharmaceuticals Ltd (CH) 2017-08-23 — — EP disclosed
WO-2016059097-A1 ANTIBACTERIAL BASIC BIAROMATIC DERIVATIVES WITH AMINOALKOXY SUBSTITUTION ACTELION PHARMACEUTICALS LTD (CH) 2016-04-21 — — 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-20170305927-A1 ANTIBACTERIAL BASIC BIAROMATIC DERIVATIVES WITH AMINOALKOXY SUBSTITUTION RPSA, RPL4, RPS4Y1 FFAR4 912/4885TLR7 1315/4885BACE1 4186/4885

“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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