SCHEMBL3169537

SCHEMBL3169537

CC(=CC(=O)Cl)C(F)(F)F

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8172304 1.00
SCHEMBL3169531 1.00
SCHEMBL8582042 0.78 ALDH1A1 (0.33)
SCHEMBL9001237 0.78 ALDH1A1 (0.33)
SCHEMBL8582044 0.78 ALDH1A1 (0.33)
SCHEMBL936905 0.76 NR4A1 (0.41)
SCHEMBL936907 0.76 NR4A1 (0.41)
SCHEMBL3454104 0.76 NR4A1 (0.41)
SCHEMBL20354575 0.74
Hydrochloric Acid SCHEMBL3169541 0.74 NR4A1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737303-B2 Production of chirally pure amino alcohol intermediates, derivatives thereof, and uses thereof WYETH LLC (US) 2010-06-15 US disclosed
US-20100016639-A1 PRODUCTION OF CHIRALLY PURE AMINO ALCOHOL INTERMEDIATES, DERIVATIVES THEREOF, AND USES THEREOF WYETH (US) 2010-01-21 US disclosed
US-7598422-B2 Production of chirally pure amino alcohol intermediates, derivatives thereof, and uses thereof WYETH (US) 2009-10-06 US disclosed
EP-2010478-A1 PRODUCTION OF CHIRALLY PURE AMINO ALCOHOL INTERMEDIATES, DERIVATIVES THEREOF, AND USES THEREOF Wyeth (US) 2009-01-07 EP disclosed
WO-2007127108-A1 PRODUCTION OF CHIRALLY PURE AMINO ALCOHOL INTERMEDIATES, DERIVATIVES THEREOF, AND USES THEREOF WYETH (US) 2007-11-08 WO disclosed
US-20070249869-A1 Production of chirally pure amino alcohol intermediates, derivatives thereof, and uses thereof WYETH (US) 2007-10-25 US disclosed
US-6013836-A PARTICULARLY ACTIVE AGAINST MOTHS AND BEETLES AND THEIR INSECT GROWTH REGULATING ACTIVITY WITHOUT ADVERSE IMPACT ON BENEFICIAL INSECTS; CROPS; FORESTRY ROHM AND HAAS COMPANY (US) 2000-01-11 US disclosed
US-5424333-A Anthelmintic N'-substituted-N,N'-disubstitutedhydrazines ROHM AND HAAS COMPANY (US) 1995-06-13 US disclosed
EP-0361645-B1 ORGANIC HYDRAZINE DERIVATIVES FOR PHARMACEUTICAL USE ROHM AND HAAS COMPANY (US) 1993-09-29 EP disclosed
US-5117057-A Insecticidal N' substituted-N-N'-disubstituted-hydrazines ROHM AND HAAS COMPANY (US) 1992-05-26 US disclosed
EP-0234944-B1 INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-04-10 EP disclosed
EP-0361645-A2 Organic hydrazine derivatives for pharmaceutical use ROHM AND HAAS COMPANY (US) 1990-04-04 EP disclosed
EP-0234944-A1 Insecticidal N'-substituted-N-acyl-N'-alkylcarbonylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-02 EP disclosed