SCHEMBL9770611

SCHEMBL9770611

CN(C)C(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
GAA P10253 1/20 0.36
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP13 P45452 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL9340021 0.90 THRB (0.39) THRB
SCHEMBL27138278 0.84 THRB (0.50) THRBGAACA1CA2MMP1
SCHEMBL11181734 0.79 ALDH1A1 (0.33) THRB
SCHEMBL4425348 0.78 THRB (0.54) THRBGAACA1CA2MMP1
SCHEMBL10881496 0.78 THRB (0.54) THRBGAACA1CA2MMP1
SCHEMBL20561003 0.78 THRB (0.54) THRBGAACA1CA2MMP1
SCHEMBL9617177 0.78 THRB (0.54) THRBGAACA1CA2MMP1
SCHEMBL28767720 0.77 THRB (0.52) THRBCA1CA2MMP1MMP2
SCHEMBL11821684 0.76 THRB (0.52) THRBCA1CA2MMP1MMP2
Trimethylammonium SCHEMBL28341032 0.76 THRB (0.81) THRBGAACA1CA2MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5051330-A For image development EASTMAN KODAK COMPANY (US) 1991-09-24 US disclosed