SCHEMBL29905593

SCHEMBL29905593

F/C(=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
LMNA P02545 1/20 0.35
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 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
SCHEMBL7602959 1.00 THRB (0.46) THRBLMNACA1CA2MMP1
SCHEMBL9424657 1.00 THRB (0.46) THRBLMNACA1CA2MMP1
SCHEMBL320598 1.00 THRB (0.46) THRBLMNACA1CA2MMP1
SCHEMBL333072 0.97 THRB (0.42) THRBLMNA
SCHEMBL333073 0.97 THRB (0.42) THRBLMNA
SCHEMBL9211057 0.97 THRB (0.42) THRBLMNA
Ethane SCHEMBL28051354 0.95 THRB (0.42) THRBLMNA
SCHEMBL8380164 0.91 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL5374510 0.91 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL5365862 0.91 THRB (0.52) THRBLMNACA1CA2MMP1

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-11442013-B2 Sensor membrane, sensor cap and/or optical sensor and method for manufacturing a sensor membrane ENDRESS+HAUSER CONDUCTA GMBH+CO. KG (DE) 2022-09-13 US disclosed