SCHEMBL6206854

SCHEMBL6206854

O=c1[nH]c2ccccc2n1CCc1cccnc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
HTT P42858 3/20 0.54
HPGD P15428 2/20 0.54
MAPT P10636 2/20 0.54
TSHR P16473 2/20 0.54
MAPK1 P28482 2/20 0.54
ALDH1A1 P00352 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
MEN1 O00255 1/20 0.53
CYP1A2 P05177 1/20 0.53
KMT2A Q03164 1/20 0.53
POLB P06746 1/20 0.50
PKM P14618 1/20 0.48
MAPK10 P53779 1/20 0.48
RECQL P46063 1/20 0.47
HTR7 P34969 3/20 0.47
RAB9A P51151 1/20 0.47
ALOX5 P09917 1/20 0.46

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
SCHEMBL4915023 0.87 LMNA (0.62) LMNAHTTHPGDMAPTTSHR
SCHEMBL30345117 0.87 LMNA (0.62) LMNAHTTHPGDMAPTTSHR
SCHEMBL8620000 0.85 LMNA (0.56) LMNAHTTHPGDMAPTTSHR
SCHEMBL8248960 0.83 LMNA (0.64) LMNAHTTHPGDMAPTTSHR
SCHEMBL8247693 0.83 PLK1 (0.47) LMNAHTTHPGDMAPTTSHR
SCHEMBL5241377 0.82 ERCC1 (0.42) LMNAHTTHPGDMAPTTSHR
SCHEMBL21463627 0.78 MEN1 (0.54) LMNAHTTHPGDMAPTTSHR
SCHEMBL30947438 0.76 LMNA (0.78) LMNAHTTHPGDMAPTTSHR
SCHEMBL8249148 0.76 LMNA (0.68) LMNAHTTHPGDMAPTTSHR
SCHEMBL8250029 0.75 POLB (0.48) LMNAHTTHPGDMAPTTSHR

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-1539708-A1 BENZIMIDAZOLONES AND THEIR USE AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-06-15 EP disclosed
WO-2004024699-A1 BENZIMIDAZOLONES AND THEIR USE AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-25 WO disclosed