SCHEMBL19985596

SCHEMBL19985596

C/C=C\Oc1ccc(-c2ccc(C3CCC(CCC)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.30
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
OPRL1 P41146 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
SCHEMBL15723075 1.00 CYP2C9 (0.32) CYP2C9ALDH1A1MAPTHTTLMNA
SCHEMBL15723175 0.97 ALDH1A1 (0.30) CYP2C9ALDH1A1MAPTHTT
SCHEMBL15722914 0.95 CYP2C9 (0.34) CYP2C9ALDH1A1MAPTHTTLMNA
SCHEMBL15722907 0.94 FPR2 (0.31) CYP2C9ALDH1A1MAPTHTT
SCHEMBL19985604 0.93 MEN1 (0.31) CYP2C9MAPTMEN1MAPK1KMT2A
SCHEMBL15723077 0.93 MEN1 (0.31) CYP2C9MAPTMEN1MAPK1KMT2A
SCHEMBL15723088 0.92 GAA (0.33) MAPTMEN1KMT2A
SCHEMBL19985602 0.92 GAA (0.33) MAPTMEN1KMT2A
SCHEMBL19985279 0.92 CYP2C9 (0.32) CYP2C9ALDH1A1MAPTHTTLMNA
SCHEMBL15723039 0.92 CYP2C9 (0.32) CYP2C9ALDH1A1MAPTHTTLMNA

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-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed
US-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed