SCHEMBL21716654

SCHEMBL21716654

CC(C)Oc1cccc(OC(C)C)c1OC(=O)c1ccnc(CNCC(=O)N(C)CCN(C)C)c1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 16/20 0.64
▸ KDM5C P41229 10/20 0.64
▸ KDM5A P29375 7/20 0.64
▸ KDM4C Q9H3R0 2/20 0.55
▸ KDM4A O75164 4/20 0.50
▸ KDM6B O15054 1/20 0.50
▸ KDM2B Q8NHM5 1/20 0.50
▸ KDM5D Q9BY66 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KDM4B O94953 2/20 0.33
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ BRPF1 P55201 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
SCHEMBL16291539 0.91 KDM5B (0.77) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716656 0.88 KDM5B (0.59) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16912751 0.85 KDM5B (0.55) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL26862768 0.85 KDM5A (0.46) KDM5BKDM5CKDM5AKDM4CKDM4E
SCHEMBL21716662 0.83 KDM5B (0.84) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL26862784 0.81 KDM5B (0.71) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716673 0.80 KDM5B (0.82) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716663 0.78 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716669 0.77 KDM5B (0.67) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL21716677 0.77 KDM5B (0.74) 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 2 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
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.

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