SCHEMBL11375464

SCHEMBL11375464

CCOC(=O)c1ccc2c(c1)OCC(N)=N2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAOA P21397 1/20 0.48
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
MAPT P10636 4/20 0.44
RAB9A P51151 3/20 0.44
TSHR P16473 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NPC1 O15118 1/20 0.44
PTGER4 P35408 2/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
ALOX15 P16050 3/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL11330634 0.77 RAB9A (0.40) LMNACA12CA1CA2CA7
SCHEMBL4244888 0.76 CA12 (0.46) LMNACYP1A2CYP3A4MAOACA12
SCHEMBL11329885 0.74 MAPT (0.44) LMNACYP1A2CYP3A4CA2MAPT
SCHEMBL1464834 0.73 MAPK1 (0.69) LMNAMAPTRAB9ATSHRL3MBTL1
SCHEMBL1640023 0.73 RAB9A (0.73) LMNACYP1A2CYP3A4MAPTRAB9A
SCHEMBL29394052 0.73 RAB9A (0.73) LMNACYP1A2CYP3A4MAPTRAB9A
SCHEMBL29518299 0.72 CA12 (0.47) LMNACYP1A2CYP3A4MAOACA12
SCHEMBL29426140 0.72 CA12 (0.47) LMNACYP1A2CYP3A4MAOACA12
SCHEMBL1751226 0.71 MAPT (0.59) LMNACA12CA1CA2CA7
SCHEMBL20826393 0.70 MAPT (0.64) LMNAMAPTRAB9ATSHRL3MBTL1

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-4254118-A 1-Oxo-5H-pyrimido[2,1-c][1,4]benzthiazine-2-carboxylic acid esters AYERST, MCKENNA & HARRISON INC. (CA) 1981-03-03 US disclosed