SCHEMBL6901873

SCHEMBL6901873

CCCCCCCCc1cnc(-c2ccc(OCC(F)COCC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc2)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.39
RAB9A P51151 6/20 0.37
MAPT P10636 5/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MEN1 O00255 2/20 0.37
USP2 O75604 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 4/20 0.34
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
PLA2G10 O15496 1/20 0.33
PLA2G1B P04054 1/20 0.33

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
SCHEMBL6972634 1.00 RARB (0.39) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6901871 1.00 RARB (0.39) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6972630 1.00 RARB (0.39) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6977745 1.00 RARB (0.39) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6977908 0.96 RARB (0.38) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6977917 0.96 RARB (0.38) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7108487 0.94 RARB (0.38) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL7108491 0.94 RARB (0.38) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6976278 0.93 RARB (0.39) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6976273 0.93 RARB (0.39) RARBRAB9AMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1131270-B1 PROCESS FOR CONVERTING AN ALCOHOL TO THE CORRESPONDING FLUORIDE 3M INNOVATIVE PROPERTIES CO (US) 2004-04-07 EP disclosed
EP-0868501-B1 PROCESS FOR CONTROLLING CONE TILT ANGLE IN MIXTURES OF SMECTIC LIQUID CRYSTAL COMPOUNDS MINNESOTA MINING & MFG (US) 2003-08-13 EP disclosed
EP-0821719-B1 LIQUID CRYSTAL COMPOUNDS HAVING A CHIRAL FLUORINATED TERMINAL PORTION MINNESOTA MINING & MFG (US) 2003-01-02 EP disclosed
US-6248889-B1 FORMING MIXTURE COMPRISING AT LEAST ONE FLUORINATED, SATURATED ALIPHATIC OR ALICYCLIC SULFONYL FLUORIDE AND AT LEAST ONE PRIMARY OR SECONDARY ALCOHOL, ADDING MOLAR EXCESS OF STRONG, APROTIC, NON-NUCLEOPHILIC HINERED ORGANIC BASE 3M INNOVATIVE PROPERTIES COMPANY 2001-06-19 US disclosed