SCHEMBL22736272

SCHEMBL22736272

N#CC1(NC(=O)n2cc(-c3ccnc4[nH]c(=O)[nH]c34)cn2)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.38
▸ BTK Q06187 7/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ CTSL P07711 2/20 0.33
▸ CTSK P43235 1/20 0.33
▸ JAK2 O60674 4/20 0.32
▸ JAK1 P23458 3/20 0.31
▸ JAK3 P52333 3/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ NAMPT P43490 1/20 0.31
▸ LIPG Q9Y5X9 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
SCHEMBL22736054 0.81 BTK (0.42) BRD4BTKJAK2JAK1JAK3
Hydrochloric Acid SCHEMBL22716905 0.80 BTK (0.42) BRD4BTKJAK2JAK1JAK3
Hydrochloric Acid SCHEMBL29480494 0.80 BTK (0.42) BRD4BTKJAK2JAK1JAK3
SCHEMBL22735989 0.80 BRD4 (0.37) BRD4BTKJAK2JAK1
SCHEMBL22736274 0.79 BRD4 (0.40) BRD4BTK
SCHEMBL22735987 0.78 BTK (0.37) BRD4BTKJAK2JAK1
SCHEMBL29567463 0.78 BTK (0.37) BRD4BTKJAK2JAK1
SCHEMBL29480525 0.78 BTK (0.41) BRD4BTKJAK2JAK1JAK3
SCHEMBL22735890 0.78 BRD4 (0.39) BRD4BTKJAK2JAK1
SCHEMBL22736239 0.78 BRD4 (0.39) BRD4BTKJAK2JAK1

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-3976612-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD (IN) 2022-04-06 — — EP claimed
US-12516056-B2 Compounds for inhibition of janus kinase 1 MANKIND PHARMA LTD. (IN) 2026-01-06 — — US disclosed
US-20220235046-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2022-07-28 — — US disclosed
EP-3976612-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD (IN) 2022-04-06 — — EP disclosed
WO-2020240586-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2020-12-03 — — 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-20220235046-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 JAK1, JAK2, JAK3 BRD4 216/4885BTK 48/4885MAPK1 20/4885

“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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