SCHEMBL28525893

SCHEMBL28525893

Cn1ccnc1CCO.F[B-](F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CNR2 P34972 1/20 0.38
LPO P22079 1/20 0.36
OPRK1 P41145 1/20 0.35
NAMPT P43490 1/20 0.34
KCNH2 Q12809 5/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
TSHR P16473 1/20 0.32

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
SCHEMBL2418078 0.92
Hydrochloric Acid SCHEMBL28039964 0.90 FDPS (0.46) FDPSMEN1KMT2ACNR2LPO
Acetic Acid SCHEMBL29005954 0.84 FDPS (0.45) FDPSMEN1KMT2ACNR2LPO
Sulfuric Acid SCHEMBL15821856 0.84 FDPS (0.45) FDPSMEN1KMT2ACNR2LPO
SCHEMBL28288135 0.83 FDPS (0.40) FDPSMEN1KMT2ACNR2LPO
SCHEMBL16699458 0.82 FDPS (0.44) FDPSMEN1KMT2ACNR2LPO
SCHEMBL31276947 0.81 FDPS (0.39) FDPSMEN1KMT2ACNR2LPO
SCHEMBL5032007 0.81 FDPS (0.45) FDPSMEN1KMT2ACNR2LPO
Propionic Acid SCHEMBL29046806 0.81 FDPS (0.43) FDPSMEN1KMT2ACNR2NAMPT
SCHEMBL2566407 0.80 KMT2A (0.41) FDPSMEN1KMT2ACNR2LPO

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-112409554-A Environment-friendly natural latex and preparation method thereof 智科通用技术研究(广州)有限公司 2021-02-26 CN claimed