SCHEMBL17518584

SCHEMBL17518584

CC(C)(C)OC(=O)n1cc(B2OC(C)(C)C(C)(C)O2)c2cc(Cl)cc(F)c21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.34
▸ BACE2 Q9Y5Z0 1/20 0.34
▸ USP30 Q70CQ3 2/20 0.33
▸ AAK1 Q2M2I8 1/20 0.32
▸ LIPE Q05469 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP3A5 P20815 1/20 0.31
▸ PRMT5 O14744 1/20 0.30
▸ WDR77 Q9BQA1 1/20 0.30

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
SCHEMBL25174282 0.89 BACE1 (0.33) BACE1BACE2USP30PRMT5WDR77
SCHEMBL30369811 0.89 BACE1 (0.33) BACE1BACE2USP30PRMT5WDR77
SCHEMBL21058443 0.85 AAK1 (0.35) BACE1BACE2USP30AAK1LIPE
SCHEMBL25029120 0.85 USP30 (0.31) USP30AAK1
SCHEMBL29361413 0.85 USP30 (0.31) USP30AAK1
SCHEMBL17504507 0.84 JAK2 (0.31) —
SCHEMBL23330822 0.83 JAK2 (0.41) BACE1BACE2USP30AAK1PRMT5
SCHEMBL20689530 0.81 USP30 (0.33) USP30PRMT5WDR77
SCHEMBL22724821 0.81 HTR6 (0.40) USP30AAK1LIPEPRMT5WDR77
SCHEMBL25028819 0.80 HTR6 (0.34) BACE1BACE2USP30AAK1PRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106573920-B Indoles for use in influenza virus infection 爱尔兰詹森科学公司 2020-11-10 — — CN disclosed
US-10597390-B2 Indoles for use in influenza virus infection JANSSEN SCIENCES IRELAND UC (IE) 2020-03-24 — — US disclosed
US-10597390-B2 Indoles for use in influenza virus infection JANSSEN SCIENCES IRELAND UC (IE) 2020-03-24 — — US disclosed
US-20190185456-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION, APPLICATION METHODS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-06-20 — — US disclosed
US-20170226102-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-08-10 — — US disclosed
US-20170226102-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-08-10 — — US disclosed
US-20170226102-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-08-10 — — US disclosed
WO-2016020526-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN SCIENCES IRELAND UC (IE) 2016-02-11 — — 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 (3 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-20190185456-A1 INHIBITORS OF INFLUENZA VIRUS REPLICATION, APPLICATION METHODS AND USES THEREOF POLRMT, EIF2AK2, POLM BACE1 2968/4885BACE2 2414/4885USP30 1402/4885
US-10597390-B2 Indoles for use in influenza virus infection IDO1, IDO2, INMT BACE1 2195/4885BACE2 2510/4885USP30 3311/4885
US-20170226102-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION IDO1, IDO2, INMT BACE1 2195/4885BACE2 2510/4885USP30 3311/4885

“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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