SCHEMBL17810057

SCHEMBL17810057

Oc1ccc2c(c1)-c1ccccc1-c1cccc3c4ccccc4n-2c13

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.46
ESR1 P03372 4/20 0.38
ESR2 Q92731 3/20 0.38
HSP90AA1 P07900 2/20 0.38
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HTT P42858 2/20 0.35
USP2 O75604 1/20 0.35
TNNI3 P19429 1/20 0.35
TNNT2 P45379 1/20 0.35
TNNC1 P63316 1/20 0.35
TLR9 Q9NR96 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL17810053 0.84 IDO1 (0.44) DUSP3ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL17809879 0.84 DUSP3 (0.44) DUSP3ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL17809832 0.81 DUSP3 (0.50) DUSP3HSP90AA1ALDH1A1MEN1KMT2A
SCHEMBL17810065 0.81 SMARCA2 (0.44) DUSP3ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL17810113 0.81 ALDH1A1 (0.43) DUSP3CDK5CDK5R1NR1H2NR1H3
SCHEMBL17810052 0.81 DUSP3 (0.42) DUSP3ALDH1A1L3MBTL1KDM4EATM
SCHEMBL17810050 0.81 DUSP3 (0.43) DUSP3ALDH1A1L3MBTL1HTTKDM4E
SCHEMBL17809990 0.80 DUSP3 (0.41) DUSP3ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL17809908 0.79 DUSP3 (0.40) DUSP3ALDH1A1L3MBTL1KDM4EATM
SCHEMBL17810097 0.79 DUSP3 (0.40) DUSP3ALDH1A1L3MBTL1KDM4EATM

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 4656/4885ESR1 190/4885ESR2 882/4885

“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.