SCHEMBL30933447

SCHEMBL30933447

CCCOCc1cc(F)c(C#Cc2ccc(-c3cc(F)c(C#N)c(F)c3)c(C(F)(F)F)c2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.35
RORC P51449 1/20 0.33
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
NSD2 O96028 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
LMNA P02545 1/20 0.31
AR P10275 2/20 0.31
PTGES O14684 1/20 0.31
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30
GBA1 P04062 2/20 0.30
LCT P09848 2/20 0.30
UGCG Q16739 2/20 0.30
GBA2 Q9HCG7 2/20 0.30
MGAM O43451 1/20 0.30
SI P14410 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
SCHEMBL30933443 0.95 KDM4E (0.35) KIF11RORCKDM4EMEN1ALDH1A1
SCHEMBL30933436 0.93 KIF11 (0.36) KIF11RORCKDM4EALDH1A1MAPT
SCHEMBL29225915 0.79 TACR1 (0.31) KIF11KDM4EMEN1ALDH1A1MAPT
SCHEMBL30933435 0.78 TRPV4 (0.30)
SCHEMBL29226101 0.78 FFAR1 (0.31)
SCHEMBL25658384 0.76 KIF11 (0.54) KIF11KDM4EALDH1A1MAPTKMT2A
SCHEMBL29226015 0.75 KDM4E (0.33) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL29225983 0.73 FFAR1 (0.34) KDM4E
SCHEMBL30933446 0.73 RARA (0.34) KDM4EMAPT
SCHEMBL29225913 0.72 TACR1 (0.32) KIF11CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118109209-A High-birefringence ferroelectric liquid crystal molecule with rigid conjugated mesogen and blended high-birefringence ferroelectric liquid crystal material 华南理工大学 2024-05-31 CN disclosed