SCHEMBL25568946

SCHEMBL25568946

c1ccc(-c2ccc(Nc3ccc(-c4cccc5ccccc45)c(-c4ccccc4)c3)cc2-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
MAPT P10636 4/20 0.48
HPGD P15428 4/20 0.41
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MPI P34949 1/20 0.41
HSD17B10 Q99714 3/20 0.41
CYP3A4 P08684 2/20 0.41
SIGMAR1 Q99720 1/20 0.40
TP53 P04637 2/20 0.40
TSHR P16473 2/20 0.40
ATM Q13315 2/20 0.40
CDC25B P30305 2/20 0.40
NFKB1 P19838 1/20 0.40
MAPK1 P28482 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL24552434 0.94 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL30545206 0.92 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL29473515 0.92 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL25247724 0.92 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL25568766 0.92 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL25568704 0.91 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL31245652 0.91 CA12 (0.47) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL28976227 0.91 CA12 (0.47) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL29597199 0.91 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL24911408 0.91 ALDH1A1 (0.46) ALDH1A1MAPTHPGDKDM4EMEN1

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
WO-2023096209-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-06-01 WO disclosed