SCHEMBL13420936

SCHEMBL13420936

Nc1ccc(CCNc2nc(NCCNc3nc(NCCc4ccc(N)cc4)nc(Nc4cccc(N)c4)n3)nc(Nc3cccc(N)c3)n2)cc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FCGR3B O75015 1/20 0.82
▸ FCGR1A P12314 1/20 0.82
▸ FCGR2A P12318 1/20 0.82
▸ KCNH3 Q9ULD8 6/20 0.53
▸ CYP19A1 P11511 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ XBP1 P17861 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ SYK P43405 1/20 0.43
▸ RECQL P46063 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL13921798 0.99 FCGR3B (0.84) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13921837 0.95 FCGR3B (0.78) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13421029 0.94 FCGR3B (0.77) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13921835 0.94 FCGR3B (0.77) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13921795 0.94 FCGR3B (0.77) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13921836 0.92 FCGR3B (0.75) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13921834 0.92 FCGR3B (0.71) FCGR3BFCGR1AFCGR2AKCNH3MEN1
SCHEMBL13921792 0.91 FCGR3B (0.73) FCGR3BFCGR1AFCGR2AKCNH3CYP19A1
SCHEMBL13917176 0.90 FCGR3B (1.00) FCGR3BFCGR1AFCGR2AKCNH3RECQL
SCHEMBL13420995 0.90 FCGR3B (0.79) FCGR3BFCGR1AFCGR2AKCNH3MEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683061-B2 Triazine dimers for the treatment of autoimmune diseases PROMETIC BIOSCIENCES INC. (CA) 2010-03-23 — — US disclosed
US-7683061-B2 Triazine dimers for the treatment of autoimmune diseases PROMETIC BIOSCIENCES INC. (CA) 2010-03-23 — — US disclosed
US-20090075867-A1 Triazine compounds and compositions thereof for the treatment of cancers PROMETIC BIOSCIENCE INC. (CA) 2009-03-19 — — US disclosed
US-20090075867-A1 Triazine compounds and compositions thereof for the treatment of cancers PROMETIC BIOSCIENCE INC. (CA) 2009-03-19 — — US disclosed
US-20070149528-A1 Triazine dimers for the treatment of autoimmune diseases PROMETIC PHARMA SMT LIMITED (GB) 2007-06-28 — — US disclosed
US-20070149528-A1 Triazine dimers for the treatment of autoimmune diseases PROMETIC PHARMA SMT LIMITED (GB) 2007-06-28 — — 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-20070149528-A1 Triazine dimers for the treatment of autoimmune diseases SSB, TLR5, ICOS FCGR3B 19/4885FCGR1A 18/4885FCGR2A 4/4885
US-20090075867-A1 Triazine compounds and compositions thereof for the treatment of cancers MCTS1, TYR, BRAF FCGR3B 4723/4885FCGR1A 4810/4885FCGR2A 4674/4885

“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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