SCHEMBL21716677

SCHEMBL21716677

CCN(CCN(C)C)C(=O)CNCc1cc(C(=O)Oc2c(O)cccc2O)ccn1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 16/20 0.74
KDM5C P41229 10/20 0.74
KDM5A P29375 7/20 0.74
KDM4C Q9H3R0 2/20 0.74
KDM4A O75164 4/20 0.68
KDM6B O15054 1/20 0.68
KDM2B Q8NHM5 1/20 0.68
KDM5D Q9BY66 1/20 0.67
KDM4B O94953 2/20 0.35
CYP2D6 P10635 2/20 0.34
ACKR3 P25106 2/20 0.33
CACNA1B Q00975 1/20 0.32

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
SCHEMBL26862784 0.89 KDM5B (0.71) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291539 0.87 KDM5B (0.77) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15637682 0.86 KDM5B (0.86) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL29373338 0.85 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15637431 0.85 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL26862785 0.84 KDM5B (0.72) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15635919 0.84 KDM5B (0.75) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716676 0.83 KDM5B (0.72) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL19676470 0.82 KDM5B (0.86) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291781 0.82 KDM5B (0.78) KDM5BKDM5CKDM5AKDM4CKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382865-A1 HISTONE DEMETHYLASE 5 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-11-30 US disclosed
US-20230382865-A1 HISTONE DEMETHYLASE 5 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-11-30 US disclosed
WO-2020033377-A1 HISTONE DEMETHYLASE 5 INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-02-13 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-20230382865-A1 HISTONE DEMETHYLASE 5 INHIBITORS AND USES THEREOF KDM5A, KDM5B, KDM5C KDM5B 2/4885KDM5C 3/4885KDM5A 1/4885

“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.