SCHEMBL28540666

SCHEMBL28540666

Cc1cccc(C2CCC3=C(N2)C(=O)CC=C3)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PBRM1 Q86U86 4/20 0.34
NPC1 O15118 1/20 0.33
HPN P05981 1/20 0.33
MAP1LC3B Q9GZQ8 1/20 0.32
CYP19A1 P11511 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GALK1 P51570 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
SCHEMBL28540668 0.84 DDB1 (0.44) HTR2CMEN1KMT2ANPC1DDB1
SCHEMBL28537495 0.84 ALDH1A1 (0.35) MEN1KMT2ANPC1
SCHEMBL28526867 0.84 SMN1; SMN2 (0.34) MEN1KMT2ADDB1CRBN
SCHEMBL28528453 0.76 TDP1 (0.36) TDP1
SCHEMBL28528607 0.74 KMT2A (0.40) MEN1KMT2AL3MBTL1
SCHEMBL28526866 0.73 PARP1 (0.39) HTR2CMEN1KMT2ADDB1CRBN
SCHEMBL28907927 0.70 ALDH1A1 (0.32)
SCHEMBL28632312 0.70
SCHEMBL28535845 0.68
SCHEMBL28527345 0.68

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-112480112-B Method for synthesizing substituted dihydrophenanthroline compound 浙江工业大学 2021-10-15 CN disclosed
CN-112480112-A Method for synthesizing substituted dihydrophenanthroline compound 浙江工业大学 2021-03-12 CN disclosed