SCHEMBL7063005

SCHEMBL7063005

CCCCCCCCCCc1cnc(-c2ccc(S(=O)(=O)C(F)(F)F)cc2)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.59
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
KMT2A Q03164 1/20 0.52
HSD17B10 Q99714 1/20 0.52
NPC1 O15118 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CA2 P00918 2/20 0.41
STAT3 P40763 1/20 0.41
ATM Q13315 1/20 0.41
KCNH2 Q12809 6/20 0.40

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
SCHEMBL7067329 1.00 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7066572 1.00 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7061028 0.84 RAB9A (0.48) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7067575 0.84 RAB9A (0.48) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL14295776 0.83 RARB (0.63) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10602751 0.80 RARB (0.62) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9850283 0.79 MAPT (0.79) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9617113 0.79 MAPT (0.79) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9850160 0.79 MAPT (0.79) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7159512 0.79 MAPT (0.79) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973844-B1 COMPOUNDS AND PROCESS FOR CONTROLLING CONE TILT ANGLE IN MIXTURES OF SMECTIC LIQUID CRYSTAL COMPOUNDS MINNESOTA MINING & MFG (US) 2003-06-04 EP disclosed
CN-1252086-A Compounds and methods for controlling cone tilt angle in mixtures of smectic liquid crystal compounds MINNESOTA MINING & MFG (US) 2000-05-03 CN disclosed
EP-0973844-A1 COMPOUNDS AND PROCESS FOR CONTROLLING CONE TILT ANGLE IN MIXTURES OF SMECTIC LIQUID CRYSTAL COMPOUNDS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-01-26 EP disclosed
US-5855812-A ALIPHATIC FLUOROCARBON TERMINAL PORTION COMPRISING A TERMINAL FLUOROALKYL OR FLUOROETHER GROUP AND AN ALKYLENE GROUP HAVING AT LEAST TWO CARBON ATOMS AND CONTAINING AT LEAST ONE CATENARY ETHER OXYGEN ATOM MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-01-05 US disclosed
WO-1998046697-A1 COMPOUNDS AND PROCESS FOR CONTROLLING CONE TILT ANGLE IN MIXTURES OF SMECTIC LIQUID CRYSTAL COMPOUNDS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-10-22 WO disclosed