SCHEMBL1890249

SCHEMBL1890249

NC(=O)c1cc(-c2ccccc2)sc1Nc1ccncc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 12/20 1.00
▸ JAK3 P52333 3/20 0.76
▸ IKBKB O14920 1/20 0.63

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
SCHEMBL1579949 0.90 JAK2 (1.00) JAK2JAK3IKBKB
SCHEMBL1579845 0.86 JAK2 (1.00) JAK2JAK3IKBKB
SCHEMBL1579439 0.86 JAK2 (0.78) JAK2JAK3IKBKB
SCHEMBL5898711 0.81 JAK2 (0.68) JAK2JAK3IKBKB
SCHEMBL3512122 0.81 JAK2 (1.00) JAK2JAK3IKBKB
SCHEMBL1579523 0.79 JAK2 (0.78) JAK2JAK3IKBKB
SCHEMBL4088216 0.78 IKBKB (0.74) JAK2JAK3IKBKB
SCHEMBL13464856 0.78 JAK2 (0.77) JAK2JAK3IKBKB
SCHEMBL13465100 0.78 JAK2 (0.69) JAK2JAK3IKBKB
SCHEMBL1385889 0.77 JAK2 (1.00) JAK2JAK3IKBKB

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-8420695-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-04-16 — — US claimed
US-20110112081-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2011-05-12 — — US claimed
US-8420695-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-04-16 — — US disclosed
US-8420695-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-04-16 — — US disclosed
US-8420695-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-04-16 — — US disclosed
US-20110112081-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2011-05-12 — — US disclosed
US-20110112081-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2011-05-12 — — US disclosed
US-20110112081-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2011-05-12 — — US disclosed
WO-2010005841-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2010-01-14 — — 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-20110112081-A1 INHIBITORS OF JANUS KINASES JAK2, JAK3, JAK1 JAK2 1/4885JAK3 2/4885IKBKB 163/4885

“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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