SCHEMBL11066635

SCHEMBL11066635

COc1cc(NC(C(=O)Cl)C(C)C)cc(OC)c1OC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
MAPT P10636 4/20 0.45
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 4/20 0.43
G6PD P11413 1/20 0.43
LMNA P02545 2/20 0.41
ALOX12 P18054 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
POLB P06746 1/20 0.40
GFER P55789 1/20 0.40
CYP3A4 P08684 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL11062887 0.86 MEN1 (0.50) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL11197844 0.86 MEN1 (0.50) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL11066625 0.81 KMT2A (0.51) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL2674642 0.76 MEN1 (0.53) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL9525229 0.74 MAPT (0.54) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL6922150 0.74 MEN1 (0.51) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL5300778 0.74 MAPT (0.58) MEN1KMT2ASMN1; SMN2MAPTMAPK1
SCHEMBL11061360 0.72 ALDH1A1 (0.48) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL11060198 0.72 ALDH1A1 (0.52) SMN1; SMN2MAPTALDH1A1LMNAHTT
SCHEMBL12932855 0.71 MAPK1 (0.51) MEN1KMT2ASMN1; SMN2MAPTMAPK1

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-4464307-A Substituted acid chloride process ZOECON CORPORATION (US) 1984-08-07 US disclosed