SCHEMBL6688243

SCHEMBL6688243

Cc1c(Cl)nc(N(Cc2ccccc2)Cc2ccccc2)c([N+](=O)[O-])c1NCCCCN(C(=O)O)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TMEM97 Q5BJF2 3/20 0.34
SIGMAR1 Q99720 3/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
DRD2 P14416 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
CHRM3 P20309 1/20 0.34
MAOA P21397 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
ADORA2A P29274 1/20 0.34
ADRA1A P35348 1/20 0.34
HRH1 P35367 1/20 0.34
DRD3 P35462 1/20 0.34
HTR2B P41595 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL6688230 1.00 LMNA (0.35) LMNASMN1; SMN2NPSR1TMEM97SIGMAR1
SCHEMBL6094679 0.85 BRD4 (0.40) NPSR1DRD2MAPTKMT2AMEN1
SCHEMBL6688237 0.76 TMEM97 (0.34) LMNASMN1; SMN2NPSR1TMEM97SIGMAR1
SCHEMBL4307213 0.76 GAA (0.43) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL6096675 0.76 BRD4 (0.41) NPSR1MAPTKMT2AMEN1
SCHEMBL14340741 0.72 LMNA (0.41) LMNASMN1; SMN2MAPTALDH1A1NR3C1
SCHEMBL4793194 0.70 BCHE (0.36) ALDH1A1KMT2APOLB
SCHEMBL5793537 0.69 KMT2A (0.40) LMNASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL5793540 0.69 KMT2A (0.40) LMNASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL4792946 0.68 GAA (0.38) LMNASMN1; SMN2NPSR1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451186-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2004-09-01 EP disclosed
WO-2003050119-A2 UREA SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-19 WO disclosed