SCHEMBL28064367

SCHEMBL28064367

O=C1CN(c2ccccc2)C(=O)N1c1ccccc1.[CaH2]

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
ALDH1A1 P00352 1/20 0.53
CTSG P08311 8/20 0.51
CMA1 P23946 7/20 0.51
ENPP2 Q13822 1/20 0.50
MGLL Q99685 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL151557 0.98 MEN1 (0.56) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL2140322 0.96 MEN1 (0.54) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL992528 0.96 MEN1 (0.54) MEN1KMT2ANPC1RAB9AALDH1A1
Ammonia Solution, Strong SCHEMBL9013686 0.94 MEN1 (0.52) MEN1KMT2ANPC1RAB9AALDH1A1
Tetramethylammonium Ion SCHEMBL5964868 0.90 MEN1 (0.48) MEN1KMT2ANPC1RAB9AALDH1A1
Sulfuric Acid SCHEMBL27724452 0.89 CTSG (0.54) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL16315766 0.89 ENPP2 (0.60) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL29847310 0.87 KMT2A (0.49) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL11142249 0.84 CMA1 (0.59) KMT2ANPC1RAB9AALDH1A1CTSG
SCHEMBL15014093 0.83 KMT2A (0.57) MEN1KMT2ANPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108245510-A Composition of cannabidiol and acryloyl urea antiepileptic drugs and application thereof 汉义生物科技(北京)有限公司 2018-07-06 CN claimed
CN-106075556-A Containing the medical recombination chitosan gel promoting wound healing medicine 四川奎星医用高分子制品有限责任公司 2016-11-09 CN claimed
CN-105999362-A Medical composite alginate dressing containing antibacterial drug and preparation method thereof 四川奎星医用高分子制品有限责任公司 2016-10-12 CN claimed
CN-105854069-A Alginate dressing containing wound-healing promoting medicine and preparing method thereof 四川奎星医用高分子制品有限责任公司 2016-08-17 CN claimed
CN-108245510-A Composition of cannabidiol and acryloyl urea antiepileptic drugs and application thereof 汉义生物科技(北京)有限公司 2018-07-06 CN disclosed
CN-106075556-A Containing the medical recombination chitosan gel promoting wound healing medicine 四川奎星医用高分子制品有限责任公司 2016-11-09 CN disclosed
CN-105999362-A Medical composite alginate dressing containing antibacterial drug and preparation method thereof 四川奎星医用高分子制品有限责任公司 2016-10-12 CN disclosed
CN-105854069-A Alginate dressing containing wound-healing promoting medicine and preparing method thereof 四川奎星医用高分子制品有限责任公司 2016-08-17 CN disclosed