SCHEMBL16912747

SCHEMBL16912747

CCCCCCCCCCCCCCCC(=O)OC[CH]COC(=O)c1ccnc(CNCC(=O)NC(C)CCN(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 14/20 0.50
▸ KDM5C P41229 8/20 0.50
▸ KDM5A P29375 7/20 0.50
▸ KDM4C Q9H3R0 2/20 0.50
▸ KDM4A O75164 2/20 0.42
▸ KDM6B O15054 1/20 0.42
▸ KDM2B Q8NHM5 1/20 0.42
▸ KDM5D Q9BY66 1/20 0.42
▸ DNM1 Q05193 1/20 0.33
▸ TLR2 O60603 2/20 0.33
▸ PTAFR P25105 3/20 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
SCHEMBL16291763 0.88 KDM5B (0.47) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291627 0.86 KDM5B (0.45) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16912748 0.85 KDM5B (0.71) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291803 0.83 KDM5B (0.67) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291681 0.81 KDM5B (0.54) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291631 0.79 KDM5B (0.54) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291429 0.79 KDM5B (0.54) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291907 0.79 KDM5B (0.53) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291579 0.77 KDM5B (0.62) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16291873 0.75 KDM5B (0.48) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10221139-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2019-03-05 — — US disclosed
US-20170320827-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2017-11-09 — — US disclosed
US-9611219-B2 — — 2017-04-04 — — US disclosed
US-20150203453-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2015-07-23 — — 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 (3 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-20150203453-A1 INHIBITORS OF HISTONE DEMETHYLASES EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5C 31/4885KDM5A 25/4885
US-20170320827-A1 INHIBITORS OF HISTONE DEMETHYLASES EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5C 31/4885KDM5A 24/4885
US-10221139-B2 Inhibitors of histone demethylases EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5C 31/4885KDM5A 24/4885

“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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