SCHEMBL8640842

SCHEMBL8640842

CCCCCCCCCC1C=CC(c2ccc(C(F)(F)F)cc2)=CC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.35
KDM1A O60341 1/20 0.32
RCOR1 Q9UKL0 1/20 0.32
LSS P48449 1/20 0.31
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KIF11 P52732 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
P2RY14 Q15391 1/20 0.30
DRD2 P14416 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
SCHEMBL8641182 1.00 TLR8 (0.35) TLR8KDM1ARCOR1LSSHTT
SCHEMBL8639780 1.00 TLR8 (0.35) TLR8KDM1ARCOR1LSSHTT
SCHEMBL8640019 1.00 TLR8 (0.35) TLR8KDM1ARCOR1LSSHTT
SCHEMBL8643219 1.00 TLR8 (0.35) TLR8KDM1ARCOR1LSSHTT
SCHEMBL8637520 0.99 TLR8 (0.36) TLR8KDM1ARCOR1HTTMEN1
SCHEMBL8637216 0.95 TLR8 (0.34) TLR8KDM1ARCOR1HTTMEN1
SCHEMBL8639440 0.89 KDM1A (0.35) KDM1ARCOR1HTTKIF11DRD2
SCHEMBL8637984 0.85 GRM2 (0.37) TLR8
SCHEMBL8637039 0.85 GRM2 (0.37) TLR8
SCHEMBL8640877 0.85 GRM2 (0.37) TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0571652-B1 Liquid crystalline substituted dihydrobenzene derivatives CITIZEN WATCH CO LTD (JP) 1998-08-05 EP disclosed
US-5342546-A Liquid crystal compositions L.C.C. CONSULTANTS CO., LTD. (JP) 1994-08-30 US disclosed
EP-0571652-A1 Liquid crystalline substituted dihydrobenzene derivatives L.C.C. CONSULTANTS CO., LTD. (JP) 1993-12-01 EP disclosed