SCHEMBL28962149

SCHEMBL28962149

N#Cc1ccccc1-c1cccnn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 2/20 0.51
GABRB3 P28472 2/20 0.51
GABRA3 P34903 2/20 0.51
GABRA5 P31644 1/20 0.51
ESR2 Q92731 1/20 0.42
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ATR Q13535 1/20 0.38
PTGES O14684 1/20 0.38
GRM5 P41594 1/20 0.38
GRIA1 P42261 1/20 0.37

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
SCHEMBL5339612 0.81 HTR2C (0.36) GABRG2GABRB3GABRA3GABRA5HTR2C
SCHEMBL31531726 0.80 GABRG2 (0.46) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL2580052 0.80 GABRG2 (0.46) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL973015 0.77 GRIA1 (0.51) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL31070227 0.77 GRIA1 (0.51) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL30102603 0.77 GRIA1 (0.51) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL5826054 0.76 GRIA1 (0.50) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL19221526 0.74 PDE3B (0.43) GABRG2GABRB3GABRA3GABRA5HPGD
SCHEMBL29412287 0.72 ESR2 (0.60) GABRG2GABRB3GABRA3GABRA5ESR2
SCHEMBL222 0.72 ESR2 (0.60) GABRG2GABRB3GABRA3GABRA5ESR2

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
CN-115558135-A High-heat-resistance polyimide film with cross-linked structure, preparation method and application 大连理工大学 2023-01-03 CN claimed