SCHEMBL17687939

SCHEMBL17687939

CC(C)(C)OC(=O)N1CC[C@H](Oc2cccc(-c3cccc(C=O)c3)n2)C1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 1/20 0.47
▸ PIK3CD O00329 15/20 0.45
▸ PIK3CA P42336 2/20 0.44
▸ PIK3CB P42338 2/20 0.44
▸ PIK3CG P48736 2/20 0.44
▸ GPR119 Q8TDV5 2/20 0.43
▸ USP30 Q70CQ3 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 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
SCHEMBL17687877 1.00 BTK (0.47) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17687881 1.00 BTK (0.47) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17687852 0.95 USP30 (0.47) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17687985 0.92 CACNB4 (0.43) BTKPIK3CDGPR119USP30FFAR4
SCHEMBL19471431 0.89 GPR119 (0.49) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL19471430 0.89 GPR119 (0.49) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL19471849 0.86 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL19471850 0.86 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL17687894 0.85 FFAR4 (0.47) GPR119USP30FFAR4
SCHEMBL17687892 0.85 FFAR4 (0.47) GPR119USP30FFAR4

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 BTK 3339/4885PIK3CD 1792/4885PIK3CA 1518/4885

“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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