SCHEMBL28068575

SCHEMBL28068575

NNc1nc2nccnc2c(=O)[nH]1.NNc1nc2nccnc2c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.40
KDM4E B2RXH2 3/20 0.40
ADORA2A P29274 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 3/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 2/20 0.34
GLA P06280 1/20 0.34
PMP22 Q01453 1/20 0.34
HSD17B10 Q99714 1/20 0.34
AKR1B1 P15121 1/20 0.33
GDA Q9Y2T3 1/20 0.33
NOS1 P29475 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
AHR P35869 1/20 0.32
KMT2A Q03164 1/20 0.32
PARP1 P09874 1/20 0.31

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
SCHEMBL1568354 1.00 GAA (0.40) GAAKDM4EADORA2ANPC1ALDH1A1
SCHEMBL29972233 0.98 GAA (0.39) GAAKDM4EADORA2ANPC1ALDH1A1
Hydrochloric Acid SCHEMBL28653465 0.98 GAA (0.39) GAAKDM4EADORA2ANPC1ALDH1A1
Sulfuric Acid SCHEMBL29043322 0.92 GAA (0.39) GAAKDM4EADORA2ANPC1ALDH1A1
Phosphoric Acid SCHEMBL29043332 0.92 GAA (0.39) GAAKDM4EADORA2ANPC1ALDH1A1
Acetic Acid SCHEMBL29043334 0.91 GAA (0.47) GAAKDM4EADORA2ANPC1ALDH1A1
Malonic Acid SCHEMBL29043333 0.89 GAA (0.40) GAAKDM4EADORA2ANPC1ALDH1A1
Glycolic Acid SCHEMBL29043327 0.88 GAA (0.39) GAAKDM4EADORA2ANPC1ALDH1A1
Fumaric Acid SCHEMBL29043337 0.88 KDM4E (0.39) GAAKDM4EADORA2ANPC1ALDH1A1
Cadaverine Tartrate SCHEMBL29043324 0.87 GAA (0.39) GAAKDM4EADORA2ANPC1ALDH1A1

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-103724432-B The antibody that the tumour of SLC34A2 (TAT211=SEQID2) is expressed in treatment and diagnosis 霍夫曼-拉罗奇有限公司 2016-06-08 CN disclosed
CN-105612179-A Monoclonal OLFML-3 antibodies and uses thereof RES DEV FOUNDATION 2016-05-25 CN disclosed