SCHEMBL8097075

SCHEMBL8097075

CCCc1ccc(C(F)F)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.45
LIPG Q9Y5X9 2/20 0.45
CA2 P00918 1/20 0.42
KMT2A Q03164 1/20 0.41
ACACB O00763 2/20 0.40
MGLL Q99685 1/20 0.39
PLK1 P53350 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
THRB P10828 2/20 0.38
HTR2A P28223 1/20 0.38
ACACA Q13085 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL8089688 0.86 CA2 (0.48) LPLLIPGCA2PLK1THRB
SCHEMBL20178575 0.83 HTR2A (0.57) LPLLIPGMGLLTHRBHTR2A
SCHEMBL12894665 0.82 LPL (0.42) LPLLIPGCA2KMT2AACACB
SCHEMBL9541031 0.80 LPL (0.41) LPLLIPGCA2KMT2AACACB
SCHEMBL2491588 0.80 LPL (0.48) LPLLIPGCA2KMT2AACACB
SCHEMBL3714185 0.80 TSHR (0.54) LPLLIPGCA2L3MBTL1
SCHEMBL142480 0.79 LPL (0.62) LPLLIPGCA2MGLLPLK1
SCHEMBL9621041 0.78 LPL (0.46) LPLLIPGCA2KMT2AACACB
SCHEMBL597719 0.78 IDO1 (0.50) LPLLIPGCA2KMT2AACACB
SCHEMBL4573831 0.77 CA2 (0.44) LPLLIPGCA2KMT2AACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4264041-A None JP disclosed
CN-113234045-A Liquid crystal compound with negative dielectric anisotropy, liquid crystal composition and liquid crystal display device 烟台显华化工科技有限公司 2021-08-10 CN disclosed
EP-3544979-B1 OXADIAZOLONES AS TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS HOFFMANN LA ROCHE (CH) 2021-08-04 EP disclosed
EP-1053990-A2 A method of producing an aromatic ketone and an aromatic ketone composition containing it TORAY INDUSTRIES, INC. (JP) 2000-11-22 EP disclosed
JP-H04264041-A PRODUCTION OF DIFLUOROMETHYLENE COMPOUND SAGAMI CHEM RES CENTER 1992-09-18 JP disclosed