SCHEMBL1573428

SCHEMBL1573428

Cc1cccc(C(C)c2nccn2CC(C)C(=O)O)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 5/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KCNH2 Q12809 2/20 0.35
POLB P06746 2/20 0.35
LMNA P02545 1/20 0.35
FPR2 P25090 1/20 0.34
TP53 P04637 2/20 0.34
ADRA2A P08913 2/20 0.34
ADRA2B P18089 2/20 0.34
ADRA2C P18825 2/20 0.34
ADRA1D P25100 2/20 0.34
ADRA1A P35348 2/20 0.34
ADRA1B P35368 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL1574142 0.88 SMN1; SMN2 (0.37) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL1573270 0.87 KMT2A (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL1573396 0.85 ITGB3 (0.37) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL1573149 0.82 PTGES (0.40) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL696323 0.82 SMN1; SMN2 (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL698574 0.82 KMT2A (0.50) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL698793 0.82 KMT2A (0.50) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL4014276 0.81 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AALDH1A1KCNH2FPR2
SCHEMBL697528 0.81 IDH1 (0.34) SMN1; SMN2KMT2AMEN1LMNATSHR
SCHEMBL696322 0.81 ALDH1A1 (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT

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-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP claimed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US claimed