SCHEMBL28797149

SCHEMBL28797149

Nc1ccc(-c2ncncn2)cc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.59
HSD17B10 Q99714 2/20 0.59
CYP3A4 P08684 2/20 0.59
PIK3CG P48736 5/20 0.43
PIK3CD O00329 2/20 0.43
ABL1 P00519 2/20 0.43
EGFR P00533 2/20 0.43
HCK P08631 2/20 0.43
SRC P12931 2/20 0.43
KDR P35968 2/20 0.43
PIK3CA P42336 2/20 0.43
PIK3CB P42338 2/20 0.43
MTOR P42345 2/20 0.43
EPHB4 P54760 2/20 0.43
PRKDC P78527 2/20 0.43
PI4KB Q9UBF8 2/20 0.43
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 2/20 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
SCHEMBL3993305 0.82 APP (0.54) CYP3A4PIK3CGMAPTQDPRAPP
SCHEMBL11524293 0.82 TDP1 (0.54) ALOX15HSD17B10CYP3A4PIK3CGPIK3CD
SCHEMBL25289869 0.79 ALOX15 (0.70) ALOX15HSD17B10CYP3A4PIK3CGPIK3CD
SCHEMBL29693507 0.79 ALOX15 (0.70) ALOX15HSD17B10CYP3A4PIK3CGPIK3CD
SCHEMBL31158162 0.77 ALDH1A1 (0.59) ALOX15HSD17B10CYP3A4MEN1KMT2A
SCHEMBL29549758 0.76 CYP3A4 (1.00) ALOX15HSD17B10CYP3A4MEN1KMT2A
SCHEMBL29365557 0.76 CYP3A4 (1.00) ALOX15HSD17B10CYP3A4MEN1KMT2A
SCHEMBL105866 0.76 CYP3A4 (1.00) ALOX15HSD17B10CYP3A4MEN1KMT2A
SCHEMBL23924225 0.76 CYP3A4 (1.00) ALOX15HSD17B10CYP3A4MEN1KMT2A
SCHEMBL4443659 0.74 KDM1A (0.36) CYP3A4MEN1KMT2AMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114773556-B Green solid-phase synthesis method of covalent organic framework material 耀科新材料(苏州)有限公司 2024-06-04 CN claimed
CN-114773556-A Green solid-phase synthesis method of covalent organic framework material 南开大学 2022-07-22 CN claimed
CN-114773556-B Green solid-phase synthesis method of covalent organic framework material 耀科新材料(苏州)有限公司 2024-06-04 CN disclosed
CN-114773556-A Green solid-phase synthesis method of covalent organic framework material 南开大学 2022-07-22 CN disclosed