SCHEMBL21452484

SCHEMBL21452484

O=NC1(c2cc(F)cc(F)c2F)CCCCC1=O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.36
RIPK1 Q13546 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
SCHEMBL21452575 0.83 TNKS (0.33) HDAC4
SCHEMBL21451904 0.79 HDAC4 (0.48) HDAC4
SCHEMBL21451949 0.76 HDAC4 (0.38) HDAC4RIPK1
SCHEMBL21452462 0.75 PDE7A (0.37)
SCHEMBL21452501 0.74 PDE7A (0.36)
SCHEMBL21452518 0.73 HDAC4 (0.34) HDAC4
SCHEMBL21451901 0.72 HDAC4 (0.37) HDAC4
SCHEMBL21452460 0.71 GRIN1 (0.45) HDAC4
SCHEMBL23490931 0.71 HDAC4 (0.35) HDAC4
SCHEMBL21452512 0.70 PDE7A (0.40) HDAC4

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
EP-3778579-A1 AROMATIC COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Jianhe Pharmaceutical & Technology Co. Ltd. (CN) 2021-02-17 EP disclosed
WO-2019192602-A1 AROMATIC COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海键合医药科技有限公司 2019-10-10 WO disclosed