SCHEMBL7657330

SCHEMBL7657330

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

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.51
THRA P10827 2/20 0.48
THRB P10828 2/20 0.48
PDK2 Q15119 3/20 0.47
MAOA P21397 2/20 0.46
PDE2A O00408 2/20 0.44
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
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
PTGDR2 Q9Y5Y4 1/20 0.41
PTPN1 P18031 1/20 0.41

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
SCHEMBL7660414 0.99 MAOB (0.50) MAOBTHRATHRBPDK2MAOA
SCHEMBL7653296 0.97 MAOB (0.53) MAOBTHRATHRBPDK2MAOA
SCHEMBL7658386 0.92 MAOB (0.50) MAOBTHRATHRBPDK2MAOA
SCHEMBL7664962 0.86 MAOB (0.51) MAOBTHRATHRBPDK2PPARD
SCHEMBL7664919 0.85 MAOB (0.50) MAOBPDK2MAOAALDH1A1GAA
SCHEMBL7656564 0.85 MAOB (0.50) MAOBTHRATHRBPDK2PPARD
SCHEMBL7659968 0.83 MAOB (0.53) MAOBTHRATHRBPDK2PPARD
SCHEMBL7665005 0.83 THRA (0.50) MAOBTHRATHRBPDK2MAOA
SCHEMBL7661551 0.82 THRA (0.52) MAOBTHRATHRBPDK2PDE2A
SCHEMBL7667020 0.80 MAOB (0.49) MAOBTHRATHRBMAOAMEN1

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