SCHEMBL5124491

SCHEMBL5124491

Cc1nc(Oc2ccccc2)c2nc(CCl)n(CC(C)C)c2c1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
TLR7 Q9NYK1 4/20 0.32
TLR8 Q9NR97 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 5/20 0.32
HTT P42858 3/20 0.32
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
CASP1 P29466 2/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CASP7 P55210 1/20 0.30

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
Bromide SCHEMBL842385 0.83 RPS6KA5 (0.34) MEN1KMT2ATLR7TLR8SMN1; SMN2
SCHEMBL1233066 0.81 KMT2A (0.42) MEN1KMT2ASMN1; SMN2ALDH1A1HTT
SCHEMBL842763 0.80 MEN1 (0.34) MEN1KMT2ATLR7SMN1; SMN2ALDH1A1
SCHEMBL4792944 0.77 HPGD (0.40) KMT2ATLR7TLR8SMN1; SMN2ALDH1A1
SCHEMBL4792366 0.76 HPGD (0.39) MEN1KMT2ATLR7TLR8SMN1; SMN2
SCHEMBL4794750 0.75 HPGD (0.39) MEN1KMT2ATLR7TLR8SMN1; SMN2
SCHEMBL4792078 0.75 HPGD (0.39) MEN1KMT2ATLR7TLR8SMN1; SMN2
SCHEMBL1233520 0.75 ALDH1A1 (0.38) KMT2ATLR7ALDH1A1
SCHEMBL1233779 0.75 ALDH1A1 (0.32) KMT2ATLR7ALDH1A1
SCHEMBL1230929 0.74 DYRK1A (0.43) KMT2ATLR7ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080015184-A1 Urea Substituted Imidazopyridines, Imidazoquinolines, and Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-01-17 US disclosed
US-20070259881-A1 Substituted Imidazo Ring Systems and Methods COLEY PHARMACEUTICAL GROUP, INC. 2007-11-08 US disclosed
WO-2006009832-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-01-26 WO disclosed
WO-2005123079-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-12-29 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 (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-20070259881-A1 Substituted Imidazo Ring Systems and Methods IL2, IL4, IRF3 MEN1 2899/4885KMT2A 2601/4885CCNE1 3606/4885
US-20080015184-A1 Urea Substituted Imidazopyridines, Imidazoquinolines, and Imidazonaphthyridines IL2, EIF2AK2, IL4 MEN1 3849/4885KMT2A 2855/4885CCNE1 2783/4885

“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.