SCHEMBL28512481

SCHEMBL28512481

O=C(/C=C(\Oc1ccc(I)cc1)c1ccccc1)Oc1ccc(I)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.42
PARP10 Q53GL7 1/20 0.40
KMT2A Q03164 6/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 1/20 0.40
TPMT P51580 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
MEN1 O00255 2/20 0.37
NSD2 O96028 1/20 0.37

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
SCHEMBL28507358 1.00 ELANE (0.42) ELANEPARP10KMT2AMAPTRAB9A
SCHEMBL28514310 0.83 ELANE (0.42) ELANEPARP10KMT2AMAPTRAB9A
SCHEMBL28512923 0.83 KMT2A (0.45) ELANEPARP10KMT2AMAPTRAB9A
SCHEMBL28513500 0.83 ELANE (0.42) ELANEPARP10KMT2AMAPTRAB9A
SCHEMBL28518223 0.83 CES2 (0.47) ELANEKMT2AMAPTRAB9ATDP1
SCHEMBL28513065 0.83 CES2 (0.47) ELANEKMT2AMAPTRAB9ATDP1
SCHEMBL28512933 0.83 KMT2A (0.45) ELANEPARP10KMT2AMAPTRAB9A
SCHEMBL2479394 0.77 PARP10 (0.65) PARP10KMT2AMAPTRAB9ATDP1
SCHEMBL11234997 0.72 PARP10 (0.59) PARP10KMT2AMAPTRAB9ATDP1
SCHEMBL27724598 0.71 NSD2 (0.47) ELANEPARP10KMT2AMAPTRAB9A

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-112174819-B Alkenyl aryl ethers and process for their preparation 江西师范大学 2023-03-28 CN disclosed
CN-112174819-A Alkenyl aryl ether and preparation method thereof 江西师范大学 2021-01-05 CN disclosed