SCHEMBL17810072

SCHEMBL17810072

N#Cc1ccc2c(c1)c1cccc3c1n2-c1ccccc1-c1ccccc1-3

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
DUSP3 P51452 1/20 0.34
AR P10275 1/20 0.34
PTGER4 P35408 1/20 0.34
ENPP3 O14638 1/20 0.34
KDM1A O60341 1/20 0.34
TDP2 O95551 2/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
RARG P13631 1/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33

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
SCHEMBL18347432 0.90 HRH1 (0.34) KDM4EALDH1A1GLAGAADUSP3
SCHEMBL18347471 0.90 PTGER4 (0.36) KDM4EDUSP3PTGER4KDM1ATDP2
SCHEMBL18347426 0.90 HRH1 (0.34) KDM4EALDH1A1GLAGAADUSP3
SCHEMBL18347449 0.90 PTGER4 (0.36) KDM4EDUSP3PTGER4KDM1ATDP2
SCHEMBL18347419 0.90 PTGER4 (0.36) KDM4EDUSP3PTGER4KDM1ATDP2
SCHEMBL18347448 0.90 HRH1 (0.34) KDM4EALDH1A1GLAGAADUSP3
SCHEMBL18347425 0.89 RPS6KB1 (0.37) KDM4EALDH1A1DUSP3PTGER4TDP2
SCHEMBL18347470 0.89 RPS6KB1 (0.37) KDM4EALDH1A1DUSP3PTGER4TDP2
SCHEMBL18347472 0.89 RPS6KB1 (0.37) KDM4EALDH1A1DUSP3PTGER4TDP2
SCHEMBL18347416 0.89 PTGER4 (0.37) KDM4EDUSP3PTGER4KDM1ATDP2

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 KDM4E 1066/4885ALDH1A1 1565/4885GLA 3575/4885

“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.