SCHEMBL1103317

SCHEMBL1103317

c1ccc2c(c1)Sc1ccccc1N2c1c2ccccc2c(N2c3ccccc3Sc3ccccc32)c2c1cnc1ccccc12

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GPR3 P46089 1/20 0.34
NOX1 Q9Y5S8 1/20 0.34
BCHE P06276 4/20 0.33
HTR2A P28223 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM1A O60341 1/20 0.32
HDAC6 Q9UBN7 1/20 0.31
PDPK1 O15530 1/20 0.31
ACHE P22303 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
SCHEMBL1103441 0.87 TLR7 (0.34) MAOAKDM4EGAAMAPTSMN1; SMN2
SCHEMBL1103607 0.83 BCHE (0.36) KDM4EGPR3BCHEMAPTACHE
SCHEMBL1103553 0.81 MET (0.39) KDM4EGPR3BCHENPSR1ACHE
SCHEMBL1103321 0.81 MPO (0.35) KDM4EGPR3PDPK1
SCHEMBL1103312 0.81 KDM4E (0.35) KDM4EGPR3HDAC6PDPK1
SCHEMBL1103328 0.81 ADORA3 (0.38) KDM4EGPR3GAAMAPTSMN1; SMN2
SCHEMBL1103323 0.81 MPO (0.35) KDM4EGPR3SMN1; SMN2NPSR1PDPK1
SCHEMBL1103313 0.80 CDK4 (0.36) KDM4EGPR3GAAMAPTSMN1; SMN2
SCHEMBL1103316 0.78 PDPK1 (0.35) KDM4EGPR3GAAMAPTSMN1; SMN2
SCHEMBL1103326 0.78 TLR7 (0.35) KDM4EGPR3BCHEPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
EP-2147962-A1 Azaanthracene-derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-27 EP 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-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 MAOA 1588/4885KDM4E 3367/4885GPR3 1503/4885

“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.