SCHEMBL7473846

SCHEMBL7473846

O=C(O)C(=NO)C1=Nc2cc(Cl)ccc2C(c2ccccc2F)=NC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
CHRM1 P11229 1/20 0.43
AURKA O14965 2/20 0.42
CYP3A4 P08684 2/20 0.39
SLC22A1 O15245 1/20 0.39
ABCB11 O95342 1/20 0.39
DRD3 P35462 1/20 0.39
OPRK1 P41145 1/20 0.39
PDE4D Q08499 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
SCHEMBL7473843 1.00 LMNA (0.45) LMNACHRM1AURKACYP3A4SLC22A1
SCHEMBL7311417 0.92 LMNA (0.47) LMNACHRM1AURKACYP3A4SLC22A1
SCHEMBL7311422 0.92 LMNA (0.47) LMNACHRM1AURKACYP3A4SLC22A1
SCHEMBL7472597 0.88 LMNA (0.42) LMNACHRM1AURKACYP3A4SLC22A1
SCHEMBL7472591 0.88 LMNA (0.42) LMNACHRM1AURKACYP3A4SLC22A1
SCHEMBL7317293 0.81 GABRA1 (0.46) LMNAOPRK1PDE4D
SCHEMBL7317291 0.81 GABRA1 (0.46) LMNAOPRK1PDE4D
SCHEMBL11610714 0.81 LMNA (0.47) LMNACHRM1AURKACYP3A4DRD3
SCHEMBL7313894 0.80 LMNA (0.44) LMNACHRM1AURKACYP3A4SLC22A1
SCHEMBL7307232 0.80 LMNA (0.44) LMNACHRM1AURKACYP3A4SLC22A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1199308-A2 Process for the preparation of imidazodiazepine intermediates Abbott Laboratories (US) 2002-04-24 EP disclosed
EP-1105392-A1 PROCESS FOR THE PREPARATION OF IMIDAZODIAZEPINE INTERMEDIATES ABBOTT LABORATORIES (US) 2001-06-13 EP disclosed
WO-2001000625-A1 PROCESS FOR THE PREPARATION OF IMIDAZODIAZEPINE INTERMEDIATES ABBOTT LABORATORIES (US) 2001-01-04 WO disclosed