SCHEMBL9856035

SCHEMBL9856035

CCOC(=O)NCCOc1ccc(O)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.59
MAPT P10636 1/20 0.59
KMT2A Q03164 2/20 0.52
GLA P06280 1/20 0.52
NPC1 O15118 2/20 0.51
MAPK1 P28482 2/20 0.50
MTNR1A P48039 2/20 0.50
MTNR1B P49286 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 1/20 0.49
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
USP2 O75604 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LTA4H P09960 3/20 0.47
NR5A1 Q13285 1/20 0.47
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46

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
SCHEMBL11320117 0.93 L3MBTL1 (0.53) L3MBTL1MAPTKMT2AGLANPC1
SCHEMBL11886540 0.89 NPC1 (0.65) L3MBTL1MAPTKMT2AGLANPC1
SCHEMBL9856606 0.86 L3MBTL1 (0.54) L3MBTL1MAPTKMT2AGLANPC1
SCHEMBL8603693 0.86 MTNR1A (0.66) L3MBTL1MAPTNPC1MTNR1AMTNR1B
SCHEMBL11841640 0.85 MTNR1A (0.58) L3MBTL1MAPTKMT2ANPC1MAPK1
SCHEMBL11309905 0.85 NPC1 (0.60) L3MBTL1MAPTKMT2AGLANPC1
SCHEMBL7201443 0.84 NR5A1 (0.65) L3MBTL1MAPTTSHRLTA4HNR5A1
Phenoxycarb SCHEMBL7944821 0.84 L3MBTL1 (0.62) L3MBTL1MAPTNPC1MTNR1AMTNR1B
SCHEMBL11886533 0.84 MMP3 (0.59) L3MBTL1MAPTKMT2AGLANPC1
Phenoxycarb SCHEMBL27336 0.84 L3MBTL1 (0.62) L3MBTL1MAPTNPC1MTNR1AMTNR1B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5037991-A Insecticides SANDOZ LTD. (CH) 1991-08-06 US disclosed
US-4968829-A ANTHELMINTICS, PARASITICIDES, NEMATOCIDES SANDOZ LTD. (CH) 1990-11-06 US disclosed
EP-0169169-B1 NOVEL AROMATIC COMPOUNDS SANDOZ AG (CH) 1990-10-17 EP disclosed
US-4697033-A INSECTICIDES SANDOZ LTD. (CH) 1987-09-29 US disclosed