SCHEMBL3661166

SCHEMBL3661166

[CH2]COC(=O)C(N=Nc1ccc(C(=O)OC)cc1)C(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.49
NPC1 O15118 8/20 0.49
SMN1; SMN2 Q16637 7/20 0.49
MAPT P10636 8/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CA1 P00915 4/20 0.38
CA2 P00918 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38

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
SCHEMBL217696 0.77 RAB9A (0.41) RAB9ANPC1SMN1; SMN2MAPTCASP3
SCHEMBL10152995 0.74 RAB9A (0.64) RAB9ANPC1SMN1; SMN2MAPTCASP3
SCHEMBL28848848 0.73 MAPT (0.47) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL5699058 0.73 RAB9A (0.56) RAB9ANPC1SMN1; SMN2MAPTCASP3
SCHEMBL11320755 0.73 CA1 (0.57) RAB9ANPC1SMN1; SMN2MAPTCASP3
SCHEMBL68345 0.73 RAB9A (0.85) RAB9ANPC1SMN1; SMN2MAPTCASP3
SCHEMBL68344 0.73 RAB9A (0.85) RAB9ANPC1SMN1; SMN2MAPTCASP3
SCHEMBL4698545 0.71 RAB9A (0.50) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL11767203 0.70 NPC1 (0.41) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL8437175 0.69 ALDH1A1 (0.47) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1

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-2212273-A2 BOTTOM ANTIREFLECTIVE COATING COMPOSITIONS AZ Electronic Materials USA Corp. (US) 2010-08-04 EP disclosed
WO-2009053832-A2 BOTTOM ANTIREFLECTIVE COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (DE) 2009-04-30 WO disclosed