SCHEMBL13428243

SCHEMBL13428243

c1ccc(-c2c3cc(N4CCCc5ccccc54)ccc3c(-c3ccc4ccccc4c3)c3ccc(N4CCCc5ccccc54)cc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.37
EED O75530 1/20 0.37
AKT1 P31749 1/20 0.36
PIK3CA P42336 1/20 0.36
NUDT1 P36639 1/20 0.36
LMNA P02545 3/20 0.35
RECQL P46063 1/20 0.35
ALDH1A1 P00352 4/20 0.35
RAB9A P51151 3/20 0.35
MAPT P10636 3/20 0.35
OPRM1 P35372 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
PTK2 Q05397 1/20 0.34
TP53 P04637 2/20 0.34
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL13426577 1.00 ROCK1 (0.37) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426669 0.99 EED (0.36) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426557 0.97 EED (0.35) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426631 0.97 EED (0.36) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426570 0.97 EED (0.36) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13428242 0.96 ROCK1 (0.39) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL10010049 0.96 ROCK1 (0.39) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426568 0.95 ROCK1 (0.37) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426642 0.95 ROCK1 (0.37) ROCK1EEDAKT1PIK3CANUDT1
SCHEMBL13426671 0.95 EED (0.35) ROCK1EEDAKT1PIK3CANUDT1

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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 US disclosed
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 US disclosed
EP-2141214-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-06 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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same RPL36, RPL39, RPL36A ROCK1 3925/4885EED 1151/4885AKT1 3459/4885

“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.