SCHEMBL10338342

SCHEMBL10338342

NCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 3/20 0.66
▸ ITGA2B P08514 3/20 0.66
▸ CHRND Q07001 5/20 0.62
▸ CHRNA1 P02708 1/20 0.62
▸ CHRNG P07510 1/20 0.62
▸ CHRNB1 P11230 1/20 0.62
▸ GRIA1 P42261 5/20 0.59

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
SCHEMBL10338341 1.00 ITGB3 (0.66) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL15186016 0.89 CHRND (0.62) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL11648896 0.89 ITGB3 (0.69) ITGB3ITGA2B
SCHEMBL10824355 0.89 NAALAD2 (0.59) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL4629789 0.89 NAALAD2 (0.59) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL8371124 0.86 FAAH (0.67) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL29026 0.86 FAAH (0.67) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL15121449 0.86 FAAH (0.67) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL17204106 0.86 FAAH (0.67) ITGB3ITGA2BCHRNDCHRNA1CHRNG
SCHEMBL4581442 0.86 FAAH (0.67) ITGB3ITGA2BCHRNDCHRNA1CHRNG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4623485-A DETERMINATION OF ALDOSTERONES BY RADIOIMMUNOASSAY OR ENZYME IMMUNOASSAY SHIONOGI & CO., LTD. (JP) 1986-11-18 — — US claimed
EP-0094251-B1 4- OR 6-SUBSTITUTED ALDOSTERONES, THEIR PRODUCTION AND USE IN IMMUNOASSAY SHIONOGI & CO., LTD. (JP) 1986-03-05 — — EP claimed
EP-0094251-A1 4- Or 6-substituted aldosterones, their production and use in immunoassay SHIONOGI & CO., LTD. (JP) 1983-11-16 — — EP claimed
US-4277460-A RADIOACTIVE IODINE DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1981-07-07 — — US claimed
US-4190593-A AMIDES OF 6-ALPHA-CARBOXYMETHYLTHIOCORTISOL DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1980-02-26 — — US claimed
JP-63060996-A — — None — — JP disclosed
JP-2057976-A — — None — — JP disclosed
JP-58194900-A — — None — — JP disclosed
JP-H0257976-A IMMUNOASSAY OF ALDOSTERONE AND KIT FOR SAID IMMUNOASSAY SHIONOGI & CO LTD 1990-02-27 — — JP disclosed
JP-S6360996-A 4-OR 6-SUBSTITUTED ALDOSTERONIC ACID, PRODUCTION AND USE THEREOF IN IMMUNOASSAY SHIONOGI & CO LTD 1988-03-17 — — JP disclosed
US-4686179-A DETERMINATION OF ALDOSTERONE BY RADIOIMMUNOASSAY AND ENZYME IMMUNOASSAY SHIONOGI & CO., LTD. (JP) 1987-08-11 — — US disclosed
US-4686179-A DETERMINATION OF ALDOSTERONE BY RADIOIMMUNOASSAY AND ENZYME IMMUNOASSAY SHIONOGI & CO., LTD. (JP) 1987-08-11 — — US disclosed
EP-0094251-B1 4- OR 6-SUBSTITUTED ALDOSTERONES, THEIR PRODUCTION AND USE IN IMMUNOASSAY SHIONOGI & CO., LTD. (JP) 1986-03-05 — — EP disclosed
EP-0094251-A1 4- Or 6-substituted aldosterones, their production and use in immunoassay SHIONOGI & CO., LTD. (JP) 1983-11-16 — — EP disclosed
EP-0094251-A1 4- Or 6-substituted aldosterones, their production and use in immunoassay SHIONOGI & CO., LTD. (JP) 1983-11-16 — — EP disclosed
JP-S58194900-A 4- OR 6-SUBSTITUTED ALDOSTERONES, ITS PREPARATION AND METHOD FOR USING THE SAME IN IMMUNOASSAY SHIONOGI & CO LTD 1983-11-12 — — JP disclosed
US-4277460-A RADIOACTIVE IODINE DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1981-07-07 — — US disclosed
US-4277460-A RADIOACTIVE IODINE DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1981-07-07 — — US disclosed
US-4190593-A AMIDES OF 6-ALPHA-CARBOXYMETHYLTHIOCORTISOL DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1980-02-26 — — US disclosed
US-4190593-A AMIDES OF 6-ALPHA-CARBOXYMETHYLTHIOCORTISOL DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1980-02-26 — — US disclosed
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