SCHEMBL18909155

SCHEMBL18909155

CSc1ccc(OC(F)F)c(-c2nn(CC(C)(C)O)cc2NC(=O)c2cnn3cccnc23)c1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.70
JAK1 P23458 20/20 0.70
TYK2 P29597 2/20 0.66
JAK3 P52333 2/20 0.66
LRRK2 Q5S007 1/20 0.65

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
SCHEMBL21280995 0.92 JAK2 (0.76) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL11028339 0.91 JAK2 (0.80) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL30052224 0.91 JAK2 (0.69) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL11032419 0.91 JAK2 (0.69) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL17282290 0.91 JAK2 (0.69) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL18893991 0.90 JAK2 (0.77) JAK2JAK1
SCHEMBL20499824 0.90 JAK2 (0.67) JAK2JAK1
SCHEMBL20560540 0.90 JAK2 (0.71) JAK2JAK1
SCHEMBL18893881 0.90 JAK2 (0.73) JAK2JAK1TYK2JAK3LRRK2
SCHEMBL11028422 0.89 JAK2 (0.69) JAK2JAK1TYK2JAK3LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220204517-A1 INHALED POWDER FORMULATIONS GENENTECH, INC. (US) 2022-06-30 US disclosed
US-20220024945-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2022-01-27 US disclosed
US-20220024945-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2022-01-27 US disclosed
US-20200165260-A1 INHALED POWDER FORMULATIONS GENENTECH, INC. (US) 2020-05-28 US disclosed
US-20200062779-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-02-27 US disclosed
US-20200062779-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-02-27 US disclosed
EP-3380474-B1 JANUS KINASES INHIBITORS, COMPOSITIONS THEREOF AND USE THEREOF HOFFMANN LA ROCHE (CH) 2019-08-21 EP disclosed
US-20180334465-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-11-22 US disclosed
WO-2017089390-A1 JANUS KINASES INHIBITORS, COMPOSITIONS THEREOF AND USE THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2017-06-01 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 (5 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-20220024945-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885TYK2 18/4885
US-20200165260-A1 INHALED POWDER FORMULATIONS JAK1, STAT5A, JAK2 JAK2 3/4885JAK1 1/4885TYK2 161/4885
US-20200062779-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885TYK2 18/4885
US-20220204517-A1 INHALED POWDER FORMULATIONS JAK1, STAT5A, JAK2 JAK2 3/4885JAK1 1/4885TYK2 161/4885
US-20180334465-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF USE THEREOF JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885TYK2 18/4885

“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.