SCHEMBL1324358

SCHEMBL1324358

CCCCNC(=O)n1c(N(C)C(=O)O)nc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ASAH1 Q13510 8/20 0.60
▸ ALDH1A1 P00352 2/20 0.59
▸ TSHR P16473 1/20 0.59
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ GAA P10253 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ TP53 P04637 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9578772 0.95 ASAH1 (0.67) ASAH1ALDH1A1TSHRGAAHTT
SCHEMBL9579226 0.93 ASAH1 (0.53) ASAH1ALDH1A1TSHRHTTTP53
Benomyl SCHEMBL8819362 0.89 TSHR (0.80) ASAH1ALDH1A1TSHRNPC1RAB9A
Benzimidazole SCHEMBL10781773 0.89 ASAH1 (0.49) ASAH1ALDH1A1TSHRNPC1RAB9A
SCHEMBL10551003 0.88 ASAH1 (0.47) ASAH1ALDH1A1TSHRRAB9AGAA
Thiophanate Methyl SCHEMBL7925889 0.86 ALDH1A1 (0.58) ASAH1ALDH1A1TSHRNPC1RAB9A
SCHEMBL9578882 0.81 KMT2A (0.47) ASAH1ALDH1A1TSHRNPC1RAB9A
SCHEMBL27523135 0.81 ASAH1 (0.65) ASAH1ALDH1A1TSHRGAAHTT
SCHEMBL7639089 0.80 ASAH1 (0.73) ASAH1ALDH1A1TSHRGAAHTT
SCHEMBL9579243 0.79 SMN1; SMN2 (0.47) ASAH1ALDH1A1TSHRNPC1RAB9A

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 185 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1111994-B1 USE OF DERIVATIVES OF METHYLENE-BIS-OXAZOLIDINE AND COMPOSITIONS THEREOF AIR LIQUIDE SANTE INT (FR) 2002-07-17 — — EP claimed
EP-0305442-B1 FUNGICIDE COMPOSITIONS CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1992-09-09 — — EP claimed
US-5043338-A Fungicide compositions CHINOIN GYOGYSZER- ES VEGYESZETI TERMEKEK GYARA, R.T. (HU) 1991-08-27 — — US claimed
US-4988693-A Methyl-N-phenylacetyl-N-2,6-xylyl-alaninate, 2,6-dimethyl-4-tridecylmorpholine with methyl-benzimidazole-2-yl-carbamate or methyl-1-butylcarbamoyl benzimidazole-2-yl carbamate CHINOIN GYOGYSZER- ES VEGYESZETI TERMEKEK GYARA, R. T. (HU) 1991-01-29 — — US claimed
EP-0230773-B1 DIPROPARGYLOXYBENZENE COMPOUNDS AND THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-23 — — EP claimed
EP-0170395-A1 Pesticidal composition CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1986-02-05 — — EP claimed
US-4152429-A AND BENOMYL AMCHEM PRODUCTS, INC. (US) 1979-05-01 — — US claimed
JP-58185504-A — — None — — JP disclosed
JP-1175910-A — — None — — JP disclosed
JP-56167606-A — — None — — JP disclosed
JP-53148531-A — — None — — JP disclosed
JP-55087709-A — — None — — JP disclosed
JP-56167605-A — — None — — JP disclosed
US-4090863-A Compositions containing 5-chloro-3-methyl-4-nitro-1H-pyrazole as fruit abscission agents DIAMOND SHAMROCK CORPORATION (US) 1978-05-23 — — US disclosed
US-4073637-A Cycloheximide-imide or carbamate combinations as fruit abscission agents DIAMOND SHAMROCK CORPORATION (US) 1978-02-14 — — US disclosed
US-4067722-A COPPER(II) COMPLEXES OF 2,3:4,6-DI-O-(SUBSTITUTED)-ALPHA-L-XYLO-2-HEXULOFURANOSONIC ACID HOFFMANN-LA ROCHE INC. (US) 1978-01-10 — — US disclosed
US-4007206-A HERBICIDE, PLANT GROWTH REGULATOR HOFFMANN-LA ROCHE INC. (US) 1977-02-08 — — US disclosed
US-3981860-A PLANT GROWTH REGULATORS, HERBICIDES HOFFMANN-LA ROCHE INC. (US) 1976-09-21 — — US disclosed
US-3932448-A FUNGICIDES, MITICIDES E. I. DU PONT DE NEMOURS & COMPANY (US) 1976-01-13 — — US disclosed
US-3931149-A PLANT GROWTH REGULATORS HOFFMANN-LA ROCHE INC. (US) 1976-01-06 — — US disclosed
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