SCHEMBL23331072

SCHEMBL23331072

O=C(Nc1cnc(Cl)n2cnnc12)C1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 7/20 0.41
▸ HDAC2 Q92769 7/20 0.41
▸ GSK3B P49841 2/20 0.39
▸ WNT1 P04628 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ HDAC3 O15379 5/20 0.38
▸ P2RX3 P56373 4/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ BRPF1 P55201 1/20 0.36
▸ CCNA2 P20248 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ GSK3A P49840 1/20 0.36

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
SCHEMBL24978675 0.93 NAMPT (0.38) HDAC1HDAC2GSK3BWNT1DYRK1A
SCHEMBL23300898 0.92 ACVRL1 (0.38) GSK3BDYRK1AKMT2AGSK3A
SCHEMBL24978410 0.89 CETP (0.40) HDAC1HDAC2HDAC3KMT2AKDM4E
SCHEMBL23331001 0.89 ALDH1A1 (0.39) HDAC1HDAC2HDAC3KMT2AKDM4E
SCHEMBL23330649 0.87 HDAC3 (0.41) HDAC1HDAC2HDAC3P2RX3KMT2A
SCHEMBL24978427 0.82 HSD17B10 (0.45) KMT2AKDM4EHSD17B10
SCHEMBL24978421 0.81 CDK2 (0.42) HDAC1HDAC2HDAC3KMT2AKDM4E
SCHEMBL23330489 0.80 MAPT (0.44) HDAC1HDAC2GSK3BDYRK1AHDAC3
SCHEMBL23330522 0.77 ALDH1A1 (0.48) GSK3BDYRK1AKMT2AKDM4EHSD17B10
SCHEMBL23331262 0.76 TP53 (0.40) KMT2AKDM4EHSD17B10

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-20230028221-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF JING MEDICINE TECHNOLOGY (SHANGHAI) LTD. (CN) 2023-01-26 — — US disclosed
WO-2021083380-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海科技大学 2021-05-06 — — 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-20230028221-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP4F11, CYP4A11, HSD11B1 HDAC1 1446/4885HDAC2 2456/4885GSK3B 75/4885

“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.

Send feedback