SCHEMBL29567670

SCHEMBL29567670

CN1CCN(CC(c2ccc(-n3cc(-c4ccnc5[nH]cnc45)cn3)nc2)C(F)(F)F)CC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 7/20 0.34
▸ KDM4A O75164 3/20 0.33
▸ KDM4B O94953 3/20 0.33
▸ KDM5C P41229 3/20 0.33
▸ KDM5B Q9UGL1 3/20 0.33
▸ PDGFRA P16234 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ HASPIN Q8TF76 1/20 0.32
▸ AURKA O14965 1/20 0.32
▸ AURKB Q96GD4 1/20 0.32
▸ INCENP Q9NQS7 1/20 0.32
▸ TPX2 Q9ULW0 1/20 0.32
▸ JAK2 O60674 1/20 0.31
▸ GRM4 Q14833 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL22736503 1.00 MELK (0.34) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL22735748 0.93 MELK (0.34) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL29567596 0.93 MELK (0.34) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL22736009 0.90 MAPK1 (0.38) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL29567579 0.90 MAPK1 (0.38) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL22735745 0.86 GRM4 (0.34) AURKAAURKBINCENPTPX2JAK2
SCHEMBL29567619 0.86 GRM4 (0.34) AURKAAURKBINCENPTPX2JAK2
SCHEMBL29567713 0.84 MAPK1 (0.42) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL22736186 0.84 MAPK1 (0.42) MELKKDM4AKDM4BKDM5CKDM5B
SCHEMBL22735800 0.83 GRM4 (0.32) AURKAAURKBINCENPTPX2JAK2

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-12516056-B2 Compounds for inhibition of janus kinase 1 MANKIND PHARMA LTD. (IN) 2026-01-06 — — US claimed
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

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 153/4885KDM4A 984/4885KDM4B 1090/4885

“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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