SCHEMBL7564432

SCHEMBL7564432

CCCCCCCCCCc1cnc(-c2ccc(OC(F)(F)C(F)(F)OCCOCCOC)cc2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.46
RAB9A P51151 7/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
MAPT P10636 5/20 0.43
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 2/20 0.43
USP2 O75604 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
NPC1 O15118 5/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL7560706 0.95 RARB (0.48) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7560950 0.95 RARB (0.48) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7560028 0.94 RARB (0.47) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7558807 0.94 RARB (0.47) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7755276 0.89 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7755482 0.88 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7750810 0.88 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7756887 0.88 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7756810 0.88 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7756932 0.88 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E

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
EP-0638112-B1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING & MFG (US) 2002-08-07 EP disclosed
US-5482650-A Liquid crystal compounds having perfluoroether terminal portions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-09 US disclosed