SCHEMBL7900520

SCHEMBL7900520

CCOC(=O)C=C(Cl)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
KMT2A Q03164 2/20 0.51
PKM P14618 1/20 0.51
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 2/20 0.46
KCNJ1 P48048 1/20 0.46
KCNH2 Q12809 1/20 0.46
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAOB P27338 1/20 0.45
AR P10275 1/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CES1 P23141 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL10850327 0.84 MAPT (0.52) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL9337350 0.84 MAPT (0.52) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL8942551 0.84 ALDH1A1 (0.55) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL853118 0.82 MAPT (0.44) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL853117 0.82 MAPT (0.44) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL6833469 0.81 CES2 (0.53) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL11218903 0.81 CES2 (0.53) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL6833468 0.81 CES2 (0.53) MAPTKMT2APKMALDH1A1SMN1; SMN2
SCHEMBL7900598 0.80 NPSR1 (0.54) MAPTKMT2APKMSMN1; SMN2LMNA
SCHEMBL21457492 0.80 MAPT (0.49) MAPTKMT2APKMALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211397-B1 CHLORINATION OF PHOSPHORANES BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed