SCHEMBL8428488

SCHEMBL8428488

CCCCOCCCCOc1cnc(-c2ccc(CCOCC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)F)cc2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.40
SMN1; SMN2 Q16637 6/20 0.40
NPC1 O15118 5/20 0.40
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 2/20 0.40
MAPT P10636 4/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 2/20 0.37
USP2 O75604 2/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.37
CYP3A4 P08684 4/20 0.33
RARB P10826 2/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
SLCO1B3 Q9NPD5 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33
CYP2D6 P10635 3/20 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
SCHEMBL7107099 0.92 RAB9A (0.46) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7094545 0.90 NPC1 (0.46) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7093544 0.90 NPC1 (0.46) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7088359 0.89 NPC1 (0.45) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7091997 0.89 NPC1 (0.45) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7088317 0.89 NPC1 (0.45) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7094197 0.88 NPC1 (0.46) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL8428820 0.87 NPC1 (0.47) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL8428671 0.86 RAB9A (0.36) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10
SCHEMBL7091841 0.86 RARB (0.44) RAB9ASMN1; SMN2NPC1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5928562-A HAVING EXTENDED HYDROCARBON ETHER GROUP ADJACENT TO A TERMINAL FLUOROALKYL OR FLUOROETHER GROUP; LOW VISCOSITY; HIGH SPEED RESPONSE; BRIGHTNESS; COMMPATIBILITY; DISPLAYS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-07-27 US disclosed