SCHEMBL4698545

SCHEMBL4698545

C#COC(=O)C(N=Nc1ccc(C(=O)OCC)cc1)C(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.50
MAPT P10636 4/20 0.50
NPC1 O15118 2/20 0.50
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
ACHE P22303 1/20 0.42
NOS3 P29474 2/20 0.41
NOS1 P29475 2/20 0.41
NOS2 P35228 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAOA P21397 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40

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
SCHEMBL5699058 0.83 RAB9A (0.56) RAB9AMAPTNPC1CA12CA1
SCHEMBL4701487 0.82 NPC1 (0.39) RAB9AMAPTNPC1CA12CA2
SCHEMBL28848848 0.78 MAPT (0.47) RAB9AMAPTNPC1CA12CA1
SCHEMBL217658 0.78 MAPT (0.47) RAB9AMAPTNPC1CA12CA1
SCHEMBL3080726 0.75 MAPT (0.75) RAB9AMAPTNPC1CA12CA1
SCHEMBL3080728 0.75 MAPT (0.75) RAB9AMAPTNPC1CA12CA1
SCHEMBL18821709 0.72 MAPT (0.67) RAB9AMAPTNPC1CA12CA1
SCHEMBL11767203 0.72 NPC1 (0.41) RAB9AMAPTNPC1CA12CA1
SCHEMBL8437175 0.72 ALDH1A1 (0.47) RAB9AMAPTNPC1ACHELMNA
SCHEMBL8437177 0.72 ALDH1A1 (0.47) RAB9AMAPTNPC1ACHELMNA

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-1845415-B1 Process for producing an image using a first minimum bottom antireflective coating composition AZ ELECTRONIC MATERIALS USA (US) 2014-04-30 EP claimed
EP-1465877-B1 POSITIVE-WORKING PHOTOIMAGEABLE BOTTOM ANTIREFLECTIVE COATING AZ ELECTRONIC MATERIALS USA (US) 2008-09-24 EP claimed