SCHEMBL11558690

SCHEMBL11558690

CC(=O)N(C)C(=O)Oc1cccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
HSD17B10 Q99714 3/20 0.61
PGR P06401 1/20 0.61
GAA P10253 1/20 0.61
PTGS1 P23219 1/20 0.61
MAPK1 P28482 1/20 0.61
NCEH1 Q6PIU2 11/20 0.54
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
RAB9A P51151 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
LMNA P02545 1/20 0.51
KDM4E B2RXH2 3/20 0.50
HPGD P15428 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
MMP2 P08253 1/20 0.49

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
SCHEMBL594455 0.87 ALDH1A1 (0.58) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL30524163 0.86 NCEH1 (0.69) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL11302392 0.86 ALDH1A1 (0.65) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL7195084 0.86 ALDH1A1 (0.56) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL27341784 0.85 HSD17B10 (0.63) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL11102022 0.83 ALDH1A1 (0.54) ALDH1A1HSD17B10PGRGAAPTGS1
Alpha-Naphthylacetate SCHEMBL76633 0.80 ALDH1A1 (0.66) ALDH1A1HSD17B10PGRGAAPTGS1
Alpha-Naphthylacetate SCHEMBL29372782 0.80 ALDH1A1 (0.66) ALDH1A1HSD17B10PGRGAAPTGS1
Alpha-Naphthylacetate SCHEMBL11320989 0.79 ALDH1A1 (0.64) ALDH1A1HSD17B10PGRGAAPTGS1
Alpha-Naphthylacetate SCHEMBL14715837 0.79 ALDH1A1 (0.64) ALDH1A1HSD17B10PGRGAAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4172146-A Substituted phenyl derivatives CIBA-GEIGY CORPORATION (US) 1979-10-23 US disclosed
US-4153604-A INSECTICIDES CIBA-GEIGY CORPORATION (US) 1979-05-08 US disclosed
US-4069344-A INSECTICIDAL SUBSTITUTED PHENYL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-01-17 US disclosed
US-4067972-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1978-01-10 US disclosed
US-4017563-A INSECTICIDES, REDUCED TOXICITY TO MAMMALS CIBA-GEIGY AG (CH) 1977-04-12 US disclosed
US-4003964-A ACARICIDES, INSECTICIDES, NEMATOCIDES CIBA-GEIGY AG (CH) 1977-01-18 US disclosed
US-3998855-A INSECTICIDES CIBA-GEIGY CORPORATION (US) 1976-12-21 US disclosed
US-3973010-A Insecticidal and acaricidal composition and method with triazolyl phosphoric esters acid CIBA-GEIGY CORPORATION (US) 1976-08-03 US disclosed
US-3969517-A INSECTICIDE, MITICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3969444-A PESTICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3969438-A PESTICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3966921-A NEMATOCIDES CIBA-GEIGY CORPORATION (US) 1976-06-29 US disclosed
US-3956306-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed
US-3948940-A Pesticidal phthalimido phosphorous ester compounds CIBA-GEIGY CORPORATION (US) 1976-04-06 US disclosed
US-3935224-A 4H-Pyrido[3,2a]-1,3,2-dioxophosphorane derivatives CIBA-GEIGY CORPORATION (US) 1976-01-27 US disclosed
US-3934010-A MITICIDE CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed