SCHEMBL22716875

SCHEMBL22716875

OC(c1ccc(-n2cc(-c3ccnc4[nH]cnc34)cn2)nc1)(C1CCNCC1)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 6/20 0.34
▸ HDAC4 P56524 1/20 0.32
▸ PDGFRA P16234 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ HASPIN Q8TF76 1/20 0.31
▸ GRM4 Q14833 3/20 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
SCHEMBL29480614 1.00 MELK (0.34) MELKHDAC4PDGFRAFLT3HASPIN
SCHEMBL29480597 0.95 HDAC4 (0.34) HDAC4GRM4
SCHEMBL22736027 0.95 HDAC4 (0.34) HDAC4GRM4
SCHEMBL29480513 0.93 HDAC4 (0.33) HDAC4GRM4
SCHEMBL22735900 0.93 HDAC4 (0.33) HDAC4GRM4
SCHEMBL22716786 0.92 HDAC4 (0.33) HDAC4GRM4
SCHEMBL29480492 0.92 HDAC4 (0.33) HDAC4GRM4
SCHEMBL22735905 0.91 GCG (0.33) MELKHDAC4GRM4
SCHEMBL29480598 0.91 GCG (0.33) MELKHDAC4GRM4
SCHEMBL22735904 0.90 KDM4A (0.36) MELKHDAC4PDGFRAFLT3HASPIN

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
US-20220235046-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2022-07-28 — — US claimed
WO-2020240586-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2020-12-03 — — WO 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
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 MELK 153/4885HDAC4 1949/4885PDGFRA 187/4885

“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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