SCHEMBL13487281

SCHEMBL13487281

CC1(C)c2ccccc2-c2c(-c3c4ccccc4c(-c4ccncn4)c4ccc(-c5ccc6ccccc6c5)cc34)cccc21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36
KDM4E B2RXH2 1/20 0.33
SCN9A Q15858 1/20 0.33
PIM1 P11309 1/20 0.33
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP3A4 P08684 3/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2B6 P20813 1/20 0.31
CYP2C19 P33261 1/20 0.31
ACP1 P24666 1/20 0.30

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
SCHEMBL13487177 0.92 ENPP1 (0.33) KDM4ESCN9ACYP3A4
SCHEMBL13487112 0.91 SCN9A (0.36) MAPK9SCN9ACYP17A1CYP3A4
SCHEMBL13487360 0.91 PDK2 (0.35) SCN9A
SCHEMBL13488056 0.89 MAPK9 (0.37) MAPK9MAPK10KDM4ESCN9APIM1
SCHEMBL13487273 0.89 KDM4E (0.38) KDM4EPIM1CYP11B1CYP11B2CYP17A1
SCHEMBL13487666 0.88 MAPK9 (0.36) MAPK9MAPK10KDM4ESCN9APIM1
SCHEMBL13487282 0.88 KDM4E (0.34) MAPK9MAPK10KDM4ECYP11B1CYP11B2
SCHEMBL13487277 0.88 HSD17B1 (0.37) MAPK9MAPK10KDM4ECYP11B1CYP11B2
SCHEMBL13487278 0.87 SIRT2 (0.37) MAPK9MAPK10KDM4EPIM1CYP11B1
SCHEMBL13487275 0.85 SIRT2 (0.34) KDM4EPIM1CYP11B1CYP11B2CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
EP-2108689-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-10-14 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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 MAPK9 1941/4885MAPK10 1970/4885KDM4E 3671/4885

“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.