SCHEMBL27465873

SCHEMBL27465873

C=CCN(C(C)=O)c1ccc(F)c([Ti])c1F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL27482473 0.82 ADORA2A (0.36) SMN1; SMN2TSHRALDH1A1KMT2A
SCHEMBL21634514 0.74 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1KMT2A
SCHEMBL482939 0.72
SCHEMBL27482846 0.72 ALDH1A1 (0.35) TSHRALDH1A1
SCHEMBL27465872 0.71 SMN1; SMN2 (0.36) SMN1; SMN2TSHR
SCHEMBL27482132 0.70 MLYCD (0.42) TSHRALDH1A1
SCHEMBL28357008 0.69 FSCN1 (0.42) TSHRALDH1A1KMT2A
SCHEMBL28883288 0.69 SMN1; SMN2 (0.39) SMN1; SMN2TSHRKMT2A
SCHEMBL14691956 0.67 C5AR1 (0.40) SMN1; SMN2TSHRALDH1A1KMT2AL3MBTL1
SCHEMBL28360698 0.67 TSHR (0.40) SMN1; SMN2TSHRALDH1A1KMT2AL3MBTL1

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
CN-1171122-C Optical polymerism composition 富士胶片株式会社 2004-10-13 CN disclosed
CN-1319784-A Optical polymerism composition FUJI PHOTO FILM CO LTD (JP) 2001-10-31 CN disclosed