SCHEMBL9468133

SCHEMBL9468133

CC(O)(O)C(F)(F)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 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.39
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 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
SCHEMBL9467942 1.00 LMNA (0.40) LMNATHRBCA2CA1MMP1
SCHEMBL9467370 1.00 LMNA (0.40) LMNATHRBCA2CA1MMP1
SCHEMBL9467021 1.00 LMNA (0.40) LMNATHRBCA2CA1MMP1
SCHEMBL11102573 0.80 LMNA (0.40) LMNATHRBCA2CA1MMP1
SCHEMBL14797181 0.80 LMNA (0.40) LMNATHRBCA2CA1MMP1
SCHEMBL9727323 0.80 LMNA (0.40) LMNATHRBCA2CA1MMP1
Methyl Alcohol SCHEMBL28458852 0.78 LMNA (0.50) LMNATHRBCA2CA1MMP1
SCHEMBL9293043 0.76 LMNA (0.35) LMNATHRBCA2CA1MMP1
Perflenapent SCHEMBL10496510 0.73 LMNA (0.53) LMNATHRBCA2CA1MMP1
SCHEMBL6190368 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5254660-A Polyurethanes, fluoropolymers BAYER AKTIENGESELLSCHAFT (DE) 1993-10-19 US disclosed
EP-0540976-A1 Use of polyisocyanate solutions for the impregnation of mineral substrates BAYER AG (DE) 1993-05-12 EP disclosed