SCHEMBL28537495

SCHEMBL28537495

Cc1ccc(C2CCC3=C(N2)C(=O)CC=C3)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
BLM P54132 1/20 0.32
CASP7 P55210 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ATM Q13315 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30

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
SCHEMBL28528453 0.86 TDP1 (0.36)
SCHEMBL28526867 0.86 SMN1; SMN2 (0.34) ALDH1A1SMN1; SMN2MAPTKDM4EMEN1
SCHEMBL28523534 0.85 DDB1 (0.40) ALDH1A1SMN1; SMN2MAPTKDM4EMEN1
SCHEMBL28540666 0.84 HTR2C (0.38) MEN1NPC1KMT2A
SCHEMBL28540668 0.76 DDB1 (0.44) KDM4EMEN1NPC1GAAKMT2A
SCHEMBL28528607 0.76 KMT2A (0.40) ALDH1A1SMN1; SMN2MAPTKDM4EMEN1
SCHEMBL28907927 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL14458009 0.72 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MAPTKDM4EMEN1
SCHEMBL22201146 0.72 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MAPTKDM4EMEN1
SCHEMBL28535845 0.71

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