SCHEMBL17810052

SCHEMBL17810052

Ic1ccc2c(c1)-c1ccccc1-c1cccc3c4ccccc4n-2c13

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.42
PTAFR P25105 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
FTO Q9C0B1 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CASP3 P42574 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32
TUBB8 Q3ZCM7 1/20 0.32

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
SCHEMBL17809879 0.84 DUSP3 (0.44) DUSP3KDM4EATML3MBTL1ALKBH5
SCHEMBL17809832 0.81 DUSP3 (0.50) DUSP3KDM4EATML3MBTL1ALKBH5
SCHEMBL17810113 0.81 ALDH1A1 (0.43) DUSP3KDM4EATML3MBTL1ALKBH5
SCHEMBL17810065 0.81 SMARCA2 (0.44) DUSP3KDM4EATML3MBTL1ALDH1A1
SCHEMBL17810053 0.81 IDO1 (0.44) DUSP3KDM4EATML3MBTL1BCHE
SCHEMBL17810057 0.81 DUSP3 (0.46) DUSP3KDM4EATML3MBTL1ALDH1A1
SCHEMBL17809990 0.80 DUSP3 (0.41) DUSP3KDM4EATML3MBTL1ALKBH5
SCHEMBL17809908 0.79 DUSP3 (0.40) DUSP3KDM4EATML3MBTL1ALKBH5
SCHEMBL17810097 0.79 DUSP3 (0.40) DUSP3KDM4EATML3MBTL1ALKBH5
SCHEMBL17810114 0.78 ATM (0.43) DUSP3KDM4EATML3MBTL1ALKBH5

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
US-9502667-B2 Organic electroluminescence IDEMITSU KOSAN CO., LTD. (JP) 2016-11-22 US disclosed
US-9502667-B2 Organic electroluminescence IDEMITSU KOSAN CO., LTD. (JP) 2016-11-22 US disclosed
US-20160163998-A1 ORGANIC ELECTROLUMINESCENCE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-09 US disclosed
US-20160163998-A1 ORGANIC ELECTROLUMINESCENCE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160163998-A1 ORGANIC ELECTROLUMINESCENCE EML4, ODC1, NDC1 DUSP3 4656/4885PTAFR 4658/4885KDM4E 1066/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.