SCHEMBL5583063

SCHEMBL5583063

CC1(C)COC(c2ccc(B(O)O)cc2)=N1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
HRH3 Q9Y5N1 4/20 0.47
CYP2D6 P10635 1/20 0.47
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
IL2 P60568 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MGLL Q99685 1/20 0.37

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
SCHEMBL471858 0.86 KDM4E (0.60) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL1621903 0.81 KDM4E (0.50) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL2088974 0.81 KDM4E (0.51) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL20409590 0.79 KDM4E (0.53) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL3942245 0.79 KDM4E (0.53) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL17841463 0.78 KDM4E (0.50) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL2557980 0.78 HRH3 (0.40) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL3762622 0.77 KDM4E (0.51) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL20411007 0.77 HRH3 (0.54) KDM4EHRH3CYP2D6LMNAMAPT
SCHEMBL4447566 0.77 KDM4E (0.51) KDM4EHRH3CYP2D6LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US 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-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 KDM4E 2952/4885HRH3 235/4885CYP2D6 2688/4885

“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.