SCHEMBL16291432

SCHEMBL16291432

CN(CCCc1nccn1C)C(=O)[C@@H](CO)NCc1cc(C(=O)O)ccn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 9/20 0.39
▸ KDM5A P29375 5/20 0.39
▸ KDM4A O75164 4/20 0.39
▸ KDM2B Q8NHM5 3/20 0.39
▸ KDM5C P41229 2/20 0.39
▸ KDM6B O15054 1/20 0.39
▸ SIRT2 Q8IXJ6 6/20 0.37
▸ KDM4C Q9H3R0 4/20 0.35
▸ DRD4 P21917 1/20 0.33
▸ OPRK1 P41145 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
SCHEMBL16310762 1.00 KDM5B (0.39) KDM5BKDM5AKDM4AKDM2BKDM5C
SCHEMBL19574692 0.93 KDM5B (0.41) KDM5BKDM5AKDM4AKDM2BKDM5C
SCHEMBL17772477 0.84 KDM5B (0.35) KDM5BKDM5AKDM4AKDM2BKDM5C
SCHEMBL15638915 0.81 KDM5B (0.56) KDM5BKDM5AKDM4AKDM2BKDM5C
SCHEMBL28442730 0.79 FNTA (0.35) DRD4
SCHEMBL28442734 0.79 FNTA (0.35) DRD4
SCHEMBL16291855 0.72 CTSK (0.42) OPRK1
SCHEMBL15639020 0.72 DRD4 (0.37) DRD4
SCHEMBL28436878 0.72 DRD4 (0.37) DRD4
SCHEMBL16291504 0.70 KDM5B (0.46) KDM5BKDM5AKDM4AKDM2BKDM5C

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 11 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-10189787-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2019-01-29 — — US disclosed
EP-3023415-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2017-12-06 — — EP disclosed
US-20170320827-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2017-11-09 — — US disclosed
EP-3150582-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. (US) 2017-04-05 — — EP disclosed
US-9611219-B2 — — 2017-04-04 — — US disclosed
US-9611220-B2 — — 2017-04-04 — — US disclosed
EP-2903968-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2016-12-07 — — EP disclosed
EP-3023415-A1 INHIBITORS OF HISTONE DEMETHYLASES Epitherapeutics ApS (DK) 2016-05-25 — — EP disclosed
US-20150203453-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2015-07-23 — — US disclosed
US-20140371195-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2014-12-18 — — 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 (5 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-10189787-B2 Inhibitors of histone demethylases EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5A 24/4885KDM4A 19/4885
US-20150203453-A1 INHIBITORS OF HISTONE DEMETHYLASES EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5A 25/4885KDM4A 21/4885
US-20140371195-A1 INHIBITORS OF HISTONE DEMETHYLASES EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5A 24/4885KDM4A 19/4885
US-20170320827-A1 INHIBITORS OF HISTONE DEMETHYLASES EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5A 24/4885KDM4A 19/4885
US-10221139-B2 Inhibitors of histone demethylases EHMT1, KDM1B, EHMT2 KDM5B 34/4885KDM5A 24/4885KDM4A 19/4885

“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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