SCHEMBL14101262

SCHEMBL14101262

CN(Cc1ccc(Cl)nc1)C1=NC(=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ATM Q13315 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
CHRNA1 P02708 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL230085 0.78 ALDH1A1 (0.37) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL29571581 0.78 ALDH1A1 (0.37) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL2893284 0.75 ALDH1A1 (0.42) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL2892730 0.73 MT-CO2 (0.39) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL14101254 0.73 CHRNA1 (0.41) ALDH1A1LMNAL3MBTL1CHRNA1CHRNB2
SCHEMBL611713 0.71 ALDH1A1 (0.47) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL29607692 0.71 ALDH1A1 (0.47) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL31093396 0.71 ALDH1A1 (0.47) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL31093399 0.71 ALDH1A1 (0.47) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL28473856 0.71 ALDH1A1 (0.47) ALDH1A1LMNAL3MBTL1MEN1KMT2A

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
US-7417150-B2 Azoles having an insecticidal action BAYER CROPSCIENCE AG (DE) 2008-08-26 US disclosed
US-7417150-B2 Azoles having an insecticidal action BAYER CROPSCIENCE AG (DE) 2008-08-26 US disclosed
EP-1383751-B1 NOVEL AZOLES HAVING AN INSECTICIDAL ACTION BAYER CROPSCIENCE AG (DE) 2007-01-17 EP disclosed