SCHEMBL3407231

SCHEMBL3407231

CCN(CC)c1cc(C)nc(Cl)n1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.62
MEN1 O00255 1/20 0.62
CRHR1 P34998 14/20 0.51
KDM4E B2RXH2 1/20 0.50
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
MAPT P10636 1/20 0.36

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
Propane SCHEMBL10920887 0.87 KMT2A (0.49) KMT2AMEN1CRHR1KDM4EHTT
SCHEMBL1603021 0.82 KMT2A (0.67) KMT2AMEN1CRHR1KDM4EHTT
SCHEMBL12250813 0.79 KMT2A (0.44) KMT2AMEN1CRHR1KDM4ELMNA
SCHEMBL12483305 0.78 KMT2A (0.49) KMT2AMEN1CRHR1KDM4EHTT
SCHEMBL10849722 0.77 KMT2A (0.51) KMT2AMEN1CRHR1KDM4EHTT
SCHEMBL432253 0.77 MEN1 (1.00) KMT2AMEN1KDM4EHTTLMNA
SCHEMBL30336057 0.77 MEN1 (1.00) KMT2AMEN1KDM4EHTTLMNA
SCHEMBL11515908 0.76 CRHR1 (0.44) KMT2ACRHR1KDM4ELMNACYP1A2
SCHEMBL1425326 0.76 KMT2A (0.59) KMT2AMEN1CRHR1KDM4EHTT
SCHEMBL12485791 0.76 KMT2A (0.46) KMT2AMEN1CRHR1KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11078165-B2 Compounds for treating tuberculosis NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2021-08-03 US disclosed
US-11078165-B2 Compounds for treating tuberculosis NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2021-08-03 US disclosed
US-20200231550-A1 COMPOUNDS FOR TREATING TUBERCULOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2020-07-23 US disclosed
US-20200231550-A1 COMPOUNDS FOR TREATING TUBERCULOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2020-07-23 US disclosed
WO-2018151681-A1 COMPOUNDS FOR TREATING TUBERCULOSIS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2018-08-23 WO disclosed
US-8962834-B2 Modulators of amyloid beta HOFFMANN-LA ROCHE INC. (US) 2015-02-24 US disclosed
EP-2257541-B1 MODULATORS FOR AMYLOID BETA HOFFMANN LA ROCHE (CH) 2013-08-14 EP disclosed
US-20130190302-A1 MODULATORS OF AMYLOID BETA HOFFMANN-LA ROCHE INC. (US) 2013-07-25 US disclosed
CN-101952275-A Modulators for amyloid beta HOFFMANN LA ROCHE 2011-01-19 CN disclosed
EP-2257541-A1 MODULATORS FOR AMYLOID BETA F. Hoffmann-La Roche AG (CH) 2010-12-08 EP disclosed
US-20090215759-A1 MODULATORS FOR AMYLOID BETA HOFFMANN-LA ROCHE, INC. 2009-08-27 US disclosed
WO-2009103652-A1 MODULATORS FOR AMYLOID BETA F. HOFFMANN-LA ROCHE AG (CH) 2009-08-27 WO disclosed
US-4416885-A MUSCULAR DISORDERS SOCIETE D'ETUDES DE PRODUITS CHIMIQUES (FR) 1983-11-22 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 (4 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-11078165-B2 Compounds for treating tuberculosis ATP5ME, ATP5MG, ATP5F1D KMT2A 2920/4885MEN1 4589/4885CRHR1 4648/4885
US-20200231550-A1 COMPOUNDS FOR TREATING TUBERCULOSIS ATP5ME, ATP5MG, ATP5F1D KMT2A 2920/4885MEN1 4589/4885CRHR1 4648/4885
US-20090215759-A1 MODULATORS FOR AMYLOID BETA APP, PSEN1, APOB KMT2A 2755/4885MEN1 1852/4885CRHR1 4180/4885
US-20130190302-A1 MODULATORS OF AMYLOID BETA APP, PSEN1, APOB KMT2A 2670/4885MEN1 1873/4885CRHR1 4223/4885

“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.