SCHEMBL8323909

SCHEMBL8323909

Nc1cc(C(F)(F)F)cc(Oc2ccc(C(F)(F)F)c(Oc3cc(C(F)(F)F)cc(N)c3F)c2F)c1F

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 3/20 0.35
LMNA P02545 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
PTPN5 P54829 2/20 0.32
ALDH1A1 P00352 1/20 0.32
KIF11 P52732 1/20 0.30
CFTR P13569 1/20 0.30

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
SCHEMBL8146688 0.87 EPAS1 (0.35) L3MBTL1RAB9AMAPTKDM4ECRHBP
SCHEMBL8144456 0.85 MAPT (0.34) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL8145035 0.83 KDM4E (0.33) MAPTKDM4ECRHBPCRHR2KIF11
SCHEMBL8146842 0.81 L3MBTL1 (0.33) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL8151369 0.81 MAPT (0.46) L3MBTL1MAPTNPSR1KDM4ECRHBP
SCHEMBL8145184 0.80 KDM4E (0.33) MAPTKDM4ECRHBPCRHR2KIF11
SCHEMBL8138821 0.80 MAPT (0.33) L3MBTL1MAPTLMNAATMKDM4E
SCHEMBL8147453 0.80 L3MBTL1 (0.43) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL8145778 0.79 KIF11 (0.32) MAPTKDM4ECRHBPCRHR2KIF11
SCHEMBL8151557 0.79 KDM4E (0.38) L3MBTL1RAB9AMAPTKDM4ECRHBP

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
US-5990261-A Organic optical component MITSUI CHEMICALS, INC. (JP) 1999-11-23 US disclosed
EP-0826717-A1 An organic optical component MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1998-03-04 EP disclosed