SCHEMBL9813619

SCHEMBL9813619

CCNC(=O)Oc1cccc2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.69
GAA P10253 2/20 0.69
PGR P06401 1/20 0.69
PTGS1 P23219 1/20 0.69
MAPK1 P28482 1/20 0.69
HSD17B10 Q99714 1/20 0.69
KDM4E B2RXH2 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
POLB P06746 1/20 0.54
MAPT P10636 1/20 0.54
THRB P10828 1/20 0.54
BLM P54132 1/20 0.54
HPGD P15428 2/20 0.52
NCEH1 Q6PIU2 2/20 0.52
FAAH O00519 4/20 0.50
DRD3 P35462 4/20 0.50
DRD2 P14416 3/20 0.50
CNR1 P21554 3/20 0.50

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
SCHEMBL9813597 0.85 NCEH1 (0.72) ALDH1A1GAAPGRPTGS1MAPK1
SCHEMBL18128175 0.84 ALDH1A1 (0.64) ALDH1A1GAAPGRPTGS1MAPK1
SCHEMBL9128926 0.84 GAA (0.49) ALDH1A1GAAPGRPTGS1MAPK1
SCHEMBL11058148 0.83 ALDH1A1 (0.63) ALDH1A1GAAPGRPTGS1MAPK1
SCHEMBL9813596 0.83 NCEH1 (0.65) ALDH1A1GAAPGRPTGS1MAPK1
Carbaril SCHEMBL374307 0.81 ALDH1A1 (1.00) ALDH1A1GAAPGRPTGS1MAPK1
Carbaril SCHEMBL29370871 0.81 ALDH1A1 (1.00) ALDH1A1GAAPGRPTGS1MAPK1
Carbaril SCHEMBL26737 0.81 ALDH1A1 (1.00) ALDH1A1GAAPGRPTGS1MAPK1
SCHEMBL11769392 0.81 ALDH1A1 (0.65) ALDH1A1GAAPGRPTGS1MAPK1
Carbaril SCHEMBL22587381 0.80 ALDH1A1 (0.82) ALDH1A1GAAPGRPTGS1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210069613-A1 ORGANIC GEL OR LIQUID CHROMATOGRAPHY METHOD PARMENTIER FRANCOIS (FR) 2021-03-11 US disclosed
US-10864461-B2 Organic gel or liquid chromatography method PARMENTIER FRANCOIS (FR) 2020-12-15 US disclosed
CN-102741258-B Compositions and methods of cyclofructans as separating agents BOARD OF REGENTS THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-09-30 CN disclosed
CN-1257482-A Quinoline-2-carboxylic acid derivative and its use as excitatory amino acids antagonist GLAXO WELLCOME SPA (IT) 2000-06-21 CN disclosed
EP-0178908-B1 CO-EXTRUSION OF MULTI-COMPONENT ECTOPARASITICIDAL PET COLLARS CONAGRA PET PRODUCTS, INC. (US) 1991-07-31 EP disclosed
US-4803956-A Animal collar for controlling fleas and ticks A. H. ROBINS COMPANY, INCORPORATED (US) 1989-02-14 US disclosed
EP-0178908-A2 Co-extrusion of multi-component ectoparasiticidal pet collars CONAGRA PET PRODUCTS, INC. (US) 1986-04-23 EP disclosed
US-4332817-A CARBAMATES WITH ALKANEDIOLS CELANESE CORPORATION (US) 1982-06-01 US disclosed
US-4226881-A ARYL OR HETEROCYCLIC N-ALKYL CARBAMATE, SYNERGISTIC ALKANEDIOL CELANESE CORPORATION (US) 1980-10-07 US disclosed
US-4150109-A DIAZINON, DIAZOXONE, COLLARS DICK PIERRE R G 1979-04-17 US disclosed
US-4134977-A EXTRUDING PVC AND A SURFACE POROSITY CONTROL AGENT A. H. ROBINS COMPANY, INCORPORATED (US) 1979-01-16 US disclosed