SCHEMBL8590656

SCHEMBL8590656

CCCCC[N+]1([O-])CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL8026449 0.98 TSHR (0.36) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL7398423 0.98 TSHR (0.36) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL50152 0.98 TSHR (0.36) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL11260353 0.98 TSHR (0.33) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL15572200 0.95 TSHR (0.38) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL6673774 0.95 TSHR (0.38) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL1258373 0.95 TSHR (0.38) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL9876888 0.93 TSHR (0.33) TSHRTHRBGNAI3GNAO1GNAI1
SCHEMBL1527590 0.93 CYP1A2 (0.31) CYP1A2
SCHEMBL5469877 0.90 LMNA (0.30) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4614537-A PLANT SAFENING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1986-09-30 US claimed
US-4548639-A N-Acyl-piperidone ketal compounds and their use as antidotes for protecting crop plants from herbicidal damage BAYER AKTIENGESELLSCHAFT (DE) 1985-10-22 US claimed
EP-0023308-B1 N-ACYL-PIPERIDONE CETALS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIDOTES IN THE PROTECTION OF CROP PLANTS AGAINST DAMAGE BY HERBICIDES BAYER AG (DE) 1982-12-22 EP claimed
US-4294967-A HERBICIDE ANTIDOTES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-13 US claimed
EP-0023308-A1 N-acyl-piperidone cetals, process for their preparation and their use as antidotes in the protection of crop plants against damage by herbicides BAYER AG (DE) 1981-02-04 EP claimed
US-5755993-A Peroxygen bleach composition activated by piperidone derivatives COLGATE-PALMOLIVE CO. (US) 1998-05-26 US disclosed
WO-1997024429-A1 PEROXYGEN BLEACH COMPOSITION ACTIVATED BY PIPERIDONE DERIVATIVES COLGATE-PALMOLIVE COMPANY (US) 1997-07-10 WO disclosed
US-4614537-A PLANT SAFENING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1986-09-30 US disclosed
US-4614537-A PLANT SAFENING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1986-09-30 US disclosed
US-4614537-A PLANT SAFENING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1986-09-30 US disclosed
US-4548639-A N-Acyl-piperidone ketal compounds and their use as antidotes for protecting crop plants from herbicidal damage BAYER AKTIENGESELLSCHAFT (DE) 1985-10-22 US disclosed
US-4548639-A N-Acyl-piperidone ketal compounds and their use as antidotes for protecting crop plants from herbicidal damage BAYER AKTIENGESELLSCHAFT (DE) 1985-10-22 US disclosed
US-4548639-A N-Acyl-piperidone ketal compounds and their use as antidotes for protecting crop plants from herbicidal damage BAYER AKTIENGESELLSCHAFT (DE) 1985-10-22 US disclosed
US-4396416-A PROTECTION FROM ACETANILIDE HERBICIDWS BAYER AKTIENGESELLSCHAFT (DE) 1983-08-02 US disclosed
US-4396416-A PROTECTION FROM ACETANILIDE HERBICIDWS BAYER AKTIENGESELLSCHAFT (DE) 1983-08-02 US disclosed
US-4294967-A HERBICIDE ANTIDOTES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-13 US disclosed
US-4294967-A HERBICIDE ANTIDOTES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-13 US disclosed
US-4294967-A HERBICIDE ANTIDOTES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-13 US disclosed
EP-0023308-A1 N-acyl-piperidone cetals, process for their preparation and their use as antidotes in the protection of crop plants against damage by herbicides BAYER AG (DE) 1981-02-04 EP disclosed
EP-0023308-A1 N-acyl-piperidone cetals, process for their preparation and their use as antidotes in the protection of crop plants against damage by herbicides BAYER AG (DE) 1981-02-04 EP disclosed