SCHEMBL7658386

SCHEMBL7658386

CCCOc1ccc2c(c1)CCc1cc(C(F)(F)F)ccc1-2

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
MAOA P21397 2/20 0.48
SLC2A1 P11166 1/20 0.46
PDK2 Q15119 2/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CYP1A1 P04798 2/20 0.42
CYP1B1 Q16678 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
CYP26A1 O43174 2/20 0.42
CYP24A1 Q07973 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HRH3 Q9Y5N1 3/20 0.40
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL7653296 0.94 MAOB (0.53) MAOBMAOAPDK2PPARDPPARA
SCHEMBL7657330 0.92 MAOB (0.51) MAOBMAOAPDK2PPARDPPARA
SCHEMBL7660414 0.90 MAOB (0.50) MAOBMAOAPDK2PPARDPPARA
SCHEMBL7664919 0.88 MAOB (0.50) MAOBMAOAPDK2CA1CA2
SCHEMBL7668487 0.85 MAOB (0.50) MAOBMAOASLC2A1PDK2CA1
SCHEMBL7664743 0.82 SLC2A1 (0.48) MAOBMAOASLC2A1PDK2CA1
SCHEMBL7664100 0.80 CYP24A1 (0.59) CYP26A1CYP24A1L3MBTL1
SCHEMBL7659968 0.79 MAOB (0.53) MAOBSLC2A1PDK2PPARDPPARA
SCHEMBL4887538 0.77 SLC2A1 (0.48) MAOBMAOASLC2A1PDK2CA1
SCHEMBL7664962 0.77 MAOB (0.51) MAOBPDK2PPARDPPARAL3MBTL1

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