SCHEMBL2709340

SCHEMBL2709340

O=C(CO)Nc1cnc2ccccc2c1Cl

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
BCHE P06276 8/20 0.45
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
CLK1 P49759 1/20 0.41
PABPC1 P11940 1/20 0.39
EIF4H Q15056 1/20 0.39

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
SCHEMBL20564258 0.88 ALDH1A1 (0.59) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL2682720 0.87 ALDH1A1 (0.47) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL2709571 0.86 HTT (0.51) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL202175 0.86 ALDH1A1 (0.47) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL204159 0.83 KMT2A (0.49) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL204433 0.82 BCHE (0.47) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL29642061 0.82 ALDH1A1 (0.54) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL671016 0.82 ALDH1A1 (0.54) ALDH1A1LMNAHTTSMN1; SMN2BCHE
SCHEMBL2707298 0.82 KMT2A (0.55) ALDH1A1LMNAHTTSMN1; SMN2POLB
SCHEMBL2706301 0.81 KDM4E (0.50) ALDH1A1LMNAHTTSMN1; SMN2BCHE

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
EP-1789042-B1 1-ALKOXY 1H-IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2012-05-02 EP disclosed
US-7579359-B2 1-alkoxy 1H-imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-08-25 US disclosed
EP-1789042-A4 1-ALKOXY 1H-IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2009-07-22 EP disclosed
US-20090005376-A1 imidazonaphthyridines, imidazopyridines, imidazoquinolines, and imidazote-trahydroquinolines; immunomodulators for inducing cytokine biosynthesis; for treatment of viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY 2009-01-01 US disclosed
EP-1789042-A2 1-ALKOXY 1H-IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-30 EP disclosed
WO-2006028962-A2 1-ALKOXY 1H-IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 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-20090005376-A1 imidazonaphthyridines, imidazopyridines, imidazoquinolines, and imidazote-trahydroquinolines; immunomodulators for inducing cytokine biosynthesis; for treatment of viral and neoplastic diseases IL2, IL4, IRF3 ALDH1A1 1123/4885LMNA 4281/4885HTT 3643/4885

“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.