SCHEMBL6688237

SCHEMBL6688237

Cc1c(Cl)nc(N(Cc2ccccc2)Cc2ccccc2)c([N+](=O)[O-])c1NC(CCCNC(=O)O)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 5/20 0.34
SIGMAR1 Q99720 5/20 0.34
POLB P06746 1/20 0.33
RAB9A P51151 3/20 0.33
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 3/20 0.32
LMNA P02545 4/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
THRB P10828 2/20 0.32
THRA P10827 1/20 0.32
TP53 P04637 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31

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
SCHEMBL6094679 0.78 BRD4 (0.40) MAPTNPSR1
SCHEMBL6688230 0.76 LMNA (0.35) TMEM97SIGMAR1POLBRAB9AALDH1A1
SCHEMBL6688243 0.76 LMNA (0.35) TMEM97SIGMAR1POLBRAB9AALDH1A1
SCHEMBL4307213 0.75 GAA (0.43) RAB9AALDH1A1NPC1LMNASMN1; SMN2
SCHEMBL6096675 0.69 BRD4 (0.41) MAPTNPSR1
SCHEMBL4199059 0.68 EGFR (0.54) POLBMAPTTP53
SCHEMBL4199068 0.68 EGFR (0.54) POLBMAPTTP53
SCHEMBL5793540 0.67 KMT2A (0.40) RAB9AALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL5793537 0.67 KMT2A (0.40) RAB9AALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20324343 0.66 MAPT (0.43) POLBRAB9AALDH1A1NPC1MAPT

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