SCHEMBL7892452

SCHEMBL7892452

FC(=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
LMNA P02545 1/20 0.36
CA1 P00915 1/20 0.31
CA2 P00918 1/20 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

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
SCHEMBL9218463 1.00 THRB (0.48) THRBLMNACA1CA2MMP1
SCHEMBL28015789 1.00 THRB (0.48) THRBLMNACA1CA2MMP1
SCHEMBL15012282 1.00 THRB (0.48) THRBLMNACA1CA2MMP1
SCHEMBL3027405 0.97 THRB (0.43) THRBLMNA
SCHEMBL7638470 0.94 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL5374510 0.94 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL4924486 0.94 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL5365862 0.94 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL1019945 0.94 THRB (0.52) THRBLMNACA1CA2MMP1
SCHEMBL8380164 0.94 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197987-B1 Polyfunctional perhalogenated polyorganosiloxanes and the processes for their preparation RHONE-BOULING CHIMIE (FR) 2001-03-06 US disclosed
US-6184329-B1 USED IN ANTIFOAMS, AGENTS FOR LOWERING SURFACE TENSION, DIRT REPELLENTS, ANTIADHESIVES, LUBRICANTS, OLEOPHOBIC AND/OR HYDROPHOBIC AGENTS, COATINGS; STABILITY RHONE-POULENC CHIMIE (FR) 2001-02-06 US disclosed
US-5331084-A Chemical intermediates for polyethers HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-19 US disclosed