SCHEMBL29244396

SCHEMBL29244396

C1=C(c2ncccn2)NOc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.33
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
UBE2N P61088 1/20 0.30
KMT2A Q03164 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
SCHEMBL2446923 0.82 KDM4E (0.43) NISCHTP53MAPTTSHRMAPK1
SCHEMBL3074957 0.82 ALOX5 (0.37) NISCHMEN1TP53MAPTTSHR
SCHEMBL3131316 0.76 DRD2 (0.34) NISCHMEN1TP53MAPTTSHR
SCHEMBL31540166 0.76 NISCH (0.44) NISCHMEN1TSHRKMT2A
SCHEMBL2596889 0.75 ALDH1A1 (0.32)
SCHEMBL29285253 0.71 NISCH (0.33) NISCH
SCHEMBL29664451 0.71 NISCH (0.32) NISCHMEN1TP53MAPTTSHR
SCHEMBL28032947 0.70 ADORA3 (0.42) MEN1MAPTKMT2A
SCHEMBL9368915 0.70 NISCH (0.31) NISCH
SCHEMBL2069480 0.69 NISCH (0.31) NISCH

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-118048071-B Preparation method of water-based waterproof thermal sublimation ink for uncoated paper 广东弘彩新材料有限公司 2024-07-19 CN claimed
CN-118048071-A Preparation method of water-based waterproof thermal sublimation ink for uncoated paper 广东弘彩新材料有限公司 2024-05-17 CN claimed
CN-118048071-B Preparation method of water-based waterproof thermal sublimation ink for uncoated paper 广东弘彩新材料有限公司 2024-07-19 CN disclosed
CN-118048071-A Preparation method of water-based waterproof thermal sublimation ink for uncoated paper 广东弘彩新材料有限公司 2024-05-17 CN disclosed