SCHEMBL4274368

SCHEMBL4274368

C=C1CN(CCCCC)CCCN(Cc2ccccc2)CCCN(S(=O)(=O)c2ccc(C)cc2)C1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CD4 P01730 12/20 0.81
SORT1 Q99523 1/20 0.81
TSHR P16473 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL7616547 0.90 CD4 (1.00) CD4SORT1TSHRL3MBTL1ALDH1A1
SCHEMBL4268084 0.88 CD4 (0.65) CD4SORT1ALDH1A1POLB
SCHEMBL13925215 0.85 CD4 (0.89) CD4SORT1TSHRL3MBTL1ALDH1A1
SCHEMBL4109293 0.85 CD4 (0.89) CD4SORT1TSHRALDH1A1SMN1; SMN2
SCHEMBL4103052 0.84 CD4 (0.88) CD4SORT1TSHRL3MBTL1ALDH1A1
SCHEMBL21361470 0.83 CD4 (0.86) CD4SORT1TSHRALDH1A1SMN1; SMN2
SCHEMBL4114419 0.82 CD4 (0.84) CD4SORT1TSHRL3MBTL1ALDH1A1
SCHEMBL4270231 0.81 CD4 (0.51) CD4SORT1SMN1; SMN2LMNANPSR1
SCHEMBL13925192 0.81 CD4 (0.81) CD4SORT1TSHRL3MBTL1ALDH1A1
SCHEMBL13925203 0.81 CD4 (0.68) CD4SORT1TSHRL3MBTL1ALDH1A1

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-20020019423-A1 Anti-viral triaza compounds BELL THOMAS W (US) 2002-02-14 US claimed
US-6342492-B1 VIRICIDES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2002-01-29 US claimed
US-20090048222-A1 Triaza Compound Immunoregulatory Agents BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO 2009-02-19 US disclosed
US-20040220164-A1 Triaza compound immunoregulatory agents BELL THOMAS (US) 2004-11-04 US disclosed
WO-2002080856-A2 TRIAZA COMPOUND IMMUNOREGULATORY AGENTS UNIVERSITY AND COMMUNITY COLLEGE SYSTEM OF NEVADA ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2002-10-17 WO disclosed
US-20020019423-A1 Anti-viral triaza compounds BELL THOMAS W (US) 2002-02-14 US disclosed
US-6342492-B1 VIRICIDES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2002-01-29 US disclosed
EP-0809504-A4 ANTI-VIRAL TRIAZA COMPOUNDS UNIV NEW YORK STATE RES FOUND (US) 1998-11-04 EP disclosed
EP-0809504-A1 ANTI-VIRAL TRIAZA COMPOUNDS THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1997-12-03 EP disclosed
US-5663161-A TRIAZACYCLO COMPOUNDS AS VIRICIDES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1997-09-02 US disclosed
WO-1996025167-A1 ANTI-VIRAL TRIAZA COMPOUNDS THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1996-08-22 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 (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-20020019423-A1 Anti-viral triaza compounds ZC3HAV1, MAVS, BAZ1A CD4 10/4885SORT1 4881/4885TSHR 2057/4885
US-20040220164-A1 Triaza compound immunoregulatory agents CD4, NFATC1, IKZF3 CD4 1/4885SORT1 4792/4885TSHR 463/4885
US-20090048222-A1 Triaza Compound Immunoregulatory Agents CD4, NFATC1, IKZF3 CD4 1/4885SORT1 4792/4885TSHR 463/4885

“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.