SCHEMBL23883102

SCHEMBL23883102

O=C(O)CCCCCN1Cc2ccccc2C=Cc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 3/20 0.48
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
RXFP1 Q9HBX9 1/20 0.42
HDAC8 Q9BY41 3/20 0.41
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
PTGS1 P23219 4/20 0.40
PTGS2 P35354 4/20 0.40
HTR1A P08908 1/20 0.39

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
SCHEMBL23883100 1.00 HDAC3 (0.48) HDAC3KDM4EALDH1A1HPGDMAPT
SCHEMBL27090004 0.99 HDAC3 (0.46) HDAC3KDM4EALDH1A1HPGDMAPT
SCHEMBL20139341 0.95 KDM4E (0.47) HDAC3KDM4EALDH1A1HPGDMAPT
SCHEMBL20139342 0.95 KDM4E (0.47) HDAC3KDM4EALDH1A1HPGDMAPT
SCHEMBL25697533 0.84 HDAC3 (0.51) HDAC3HDAC8HTR1ADRD2HDAC4
SCHEMBL19432848 0.80 NOTUM (0.48) HDAC3KDM4EALDH1A1MAPTMEN1
SCHEMBL9379346 0.78 HDAC3 (0.74) HDAC3KDM4EALDH1A1HPGDMAPT
SCHEMBL18730195 0.77 MAPT (0.50) HDAC3KDM4EALDH1A1HPGDMAPT
SCHEMBL25698882 0.76 HDAC3 (0.45) HDAC3KDM4EMAPTMEN1POLB
SCHEMBL23600056 0.76 HDAC3 (0.38) HDAC3KDM4EMAPTMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144068-A1 METHOD FOR PREPARING MODIFIED VECTOR AND METHOD FOR MODIFYING VECTOR KANEKA CORPORATION (JP) 2023-05-11 US claimed
US-20230144068-A1 METHOD FOR PREPARING MODIFIED VECTOR AND METHOD FOR MODIFYING VECTOR KANEKA CORPORATION (JP) 2023-05-11 US disclosed
WO-2021199764-A1 METHOD FOR PREPARING MODIFIED VECTOR AND METHOD FOR MODIFYING VECTOR 株式会社カネカ 2021-10-07 WO disclosed