SCHEMBL23786457

SCHEMBL23786457

CCc1ccccc1/C=C\c1ccccc1NC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHAT P28329 1/20 0.38
MAPT P10636 5/20 0.38
ALDH1A1 P00352 4/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 2/20 0.36
CLCN2 P51788 1/20 0.36
AR P10275 1/20 0.36
POLB P06746 4/20 0.35
KDM4E B2RXH2 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HPGD P15428 2/20 0.35
RECQL P46063 2/20 0.35
USP2 O75604 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35

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
SCHEMBL6546259 0.84 CHAT (0.47) CHATMAPTALDH1A1KMT2ANPSR1
SCHEMBL3314625 0.84 CHAT (0.47) CHATMAPTALDH1A1KMT2ANPSR1
SCHEMBL1682034 0.78 ALDH1A1 (0.50) MAPTALDH1A1GAAKMT2ACLCN2
SCHEMBL21299263 0.77 KDM4E (0.38) MAPTALDH1A1KMT2APOLBKDM4E
SCHEMBL22058627 0.77 TDP1 (0.52) MAPTALDH1A1GAAKMT2APOLB
SCHEMBL12503862 0.77 KDM4E (0.38) MAPTALDH1A1KMT2APOLBKDM4E
SCHEMBL318156 0.76 CHAT (0.54) CHATPTGER4PTGER3PTGER2
SCHEMBL318157 0.76 CHAT (0.54) CHATPTGER4PTGER3PTGER2
SCHEMBL5690553 0.76 NFE2L2 (0.46) SIGMAR1
SCHEMBL5690556 0.76 NFE2L2 (0.46) SIGMAR1

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
EP-3604384-B1 HYDROPHILIC POLYMER DERIVATIVE HAVING SELF-IMMOLATIVE ACETAL LINKER AND COMPOSITE USING SAME NOF CORP (JP) 2021-09-08 EP disclosed