SCHEMBL18159118

SCHEMBL18159118

Cc1ccccc1Cn1cnc(-c2cc(-c3nn[nH]n3)ccn2)c1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 17/20 0.77
▸ KDM5A P29375 5/20 0.77
▸ KDM2B Q8NHM5 2/20 0.71
▸ KDM5B Q9UGL1 3/20 0.67
▸ KDM4A O75164 1/20 0.60
▸ PHF8 Q9UPP1 1/20 0.59

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
SCHEMBL16075658 0.90 KDM4C (0.80) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16034058 0.87 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BPHF8
SCHEMBL16033793 0.86 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16033602 0.83 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16033516 0.83 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16033692 0.82 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16033942 0.82 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL16095229 0.82 KDM4C (0.61) KDM4CKDM5AKDM2BKDM5BKDM4A
SCHEMBL17898922 0.81 KDM5B (0.63) KDM4CKDM5AKDM2BKDM5BPHF8
SCHEMBL16033706 0.80 KDM4C (1.00) KDM4CKDM5AKDM2BKDM5BKDM4A

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-20180042905-A1 METHODS OF TREATING HEPATITIS B VIRUS GILEAD SCIENCES, INC. 2018-02-15 — — US disclosed
US-20160303095-A1 METHODS OF TREATING HEPATITIS B VIRUS GILEAD SCIENCES, INC. 2016-10-20 — — 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 (2 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-20180042905-A1 METHODS OF TREATING HEPATITIS B VIRUS KDM1B, KDM5B, KDM5A KDM4C 23/4885KDM5A 3/4885KDM2B 5/4885
US-20160303095-A1 METHODS OF TREATING HEPATITIS B VIRUS KDM1B, KDM5B, KDM5A KDM4C 23/4885KDM5A 3/4885KDM2B 5/4885

“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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