SCHEMBL4921939

SCHEMBL4921939

N=C(NN)c1cccnc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.52
F3 P13726 1/20 0.52
SARM1 Q6SZW1 1/20 0.52
SIRT2 Q8IXJ6 1/20 0.52
SIRT6 Q8N6T7 1/20 0.52
SIRT1 Q96EB6 1/20 0.52
SIRT3 Q9NTG7 1/20 0.52
SIRT5 Q9NXA8 1/20 0.52
SIRT4 Q9Y6E7 1/20 0.52
HDAC1 Q13547 2/20 0.48
HDAC6 Q9UBN7 1/20 0.48
ALDH1A1 P00352 3/20 0.48
GAA P10253 2/20 0.48
APP P05067 1/20 0.48
HCAR3 P49019 1/20 0.48
HCAR2 Q8TDS4 1/20 0.48
PLOD2 O00469 2/20 0.46
POLB P06746 1/20 0.46
THRB P10828 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL283481 0.82 HDAC1 (0.60) F7F3SARM1SIRT2SIRT6
SCHEMBL15588644 0.81 F7 (0.53) F7F3SARM1SIRT2SIRT6
SCHEMBL14595304 0.80 ALDH1A1 (0.52) F7F3SARM1SIRT2SIRT6
SCHEMBL8481624 0.79 ALDH1A1 (0.56) F7F3SARM1SIRT2SIRT6
Hydrochloric Acid SCHEMBL8485517 0.78 ALDH1A1 (0.54) F7F3SARM1SIRT2SIRT6
SCHEMBL16791193 0.77 ALDH1A1 (0.49) F7F3SARM1SIRT2SIRT6
SCHEMBL31404951 0.77
SCHEMBL415017 0.77
Nicotinic Acid Hydrazide SCHEMBL258390 0.76 HDAC1 (0.69) F7F3SARM1SIRT2SIRT6
Nicotinic Acid Hydrazide SCHEMBL29648965 0.76 HDAC1 (0.69) F7F3SARM1SIRT2SIRT6

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
WO-2016120432-A1 COMPOUNDS AND METHODS FOR ANTICOAGULATION THERAPY FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2016-08-04 WO disclosed
US-20080096894-A1 Anti-Bacterial Compounds ASTON UNIVERSITY (GB) 2008-04-24 US disclosed
EP-1845779-A1 ANTI-BACTERIAL COMPOUNDS Aston University (GB) 2007-10-24 EP disclosed
WO-2006075159-A1 ANTI-BACTERIAL COMPOUNDS ASTON UNIVERSITY (GB) 2006-07-20 WO disclosed
JP-2004083415-A NICOTINAMIDRAZONE DERIVATIVE SANKYO AGRO KK 2004-03-18 JP disclosed
WO-2004005291-A1 HETERO-CYCLICALY SUBSTITUTED IMIDAZOTRIAZINES BAYER HEALTHCARE AG (DE) 2004-01-15 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 (1 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-20080096894-A1 Anti-Bacterial Compounds MRPL21, PGLS, FOSB F7 1015/4885F3 1908/4885SARM1 3387/4885

“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.