SCHEMBL7067110

SCHEMBL7067110

CCCCCCCCc1cnc(-c2ccc(CCCCCCOCC(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
MAPT P10636 4/20 0.46
HSD17B10 Q99714 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
RARB P10826 3/20 0.44
CES1 P23141 1/20 0.36
NPC1 O15118 3/20 0.35
STAT3 P40763 1/20 0.35
ATM Q13315 1/20 0.35
S1PR4 O95977 6/20 0.35
S1PR1 P21453 6/20 0.35
S1PR5 Q9H228 6/20 0.35
S1PR3 Q99500 5/20 0.35

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
SCHEMBL7066583 0.97 RAB9A (0.47) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7067584 0.95 RAB9A (0.47) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7063012 0.95 RAB9A (0.47) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7092010 0.93 RARB (0.42) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7089161 0.93 RARB (0.41) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7091996 0.92 RARB (0.42) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7063045 0.91 SMN1; SMN2 (0.46) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7154525 0.91 SMN1; SMN2 (0.46) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL8006957 0.91 SMN1; SMN2 (0.46) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E
SCHEMBL7088446 0.91 RARB (0.41) RAB9ASMN1; SMN2MAPTHSD17B10KDM4E

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-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
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