SCHEMBL7664962

SCHEMBL7664962

CCCCCOc1ccc2c(c1)CCc1cc(OC(F)(F)F)ccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.51
THRA P10827 2/20 0.48
THRB P10828 2/20 0.48
PDK2 Q15119 3/20 0.47
FFAR4 Q5NUL3 2/20 0.42
PPARA Q07869 2/20 0.42
PPARD Q03181 1/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTPN1 P18031 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
PTPN11 Q06124 1/20 0.40
GPR3 P46089 1/20 0.40
NR5A1 Q13285 1/20 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
SCHEMBL7656564 0.99 MAOB (0.50) MAOBTHRATHRBPDK2FFAR4
SCHEMBL7659968 0.97 MAOB (0.53) MAOBTHRATHRBPDK2FFAR4
SCHEMBL7668487 0.92 MAOB (0.50) MAOBTHRATHRBPDK2FFAR4
SCHEMBL7657330 0.86 MAOB (0.51) MAOBTHRATHRBPDK2PPARA
SCHEMBL7668645 0.85 MAOB (0.46) MAOBPDK2MEN1MAPTKMT2A
SCHEMBL7660414 0.85 MAOB (0.50) MAOBTHRATHRBPDK2PPARA
SCHEMBL7665238 0.84 HTR2A (0.44) MAOBPPARAALDH1A1GPR3
SCHEMBL7653296 0.83 MAOB (0.53) MAOBTHRATHRBPDK2PPARA
SCHEMBL7665005 0.83 THRA (0.50) MAOBTHRATHRBPDK2MEN1
SCHEMBL7666383 0.83 HTR2A (0.46) PPARAALDH1A1GPR3

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-6495220-B2 WITH POSITIVE DIELECTRIC ANISOTROPY AND FAVORABLE VISCOSITY; THERMAL, LIGHT AND ULTRAVIOLET STABILITY; USE IN PORTABLE TELEPHONES AND NOTEBOOK COMPUTERS CLARIANT INTERNATIONAL LTD. (CH) 2002-12-17 US disclosed
US-20010023935-A1 With positive dielectric anisotropy and favorable viscosity; thermal, light and ultraviolet stability; use in portable telephones and notebook computers CLARIANT INTERNATIONAL LTD. (CH) 2001-09-27 US disclosed