SCHEMBL13615962

SCHEMBL13615962

c1ccc2c(c1)CCCN2c1ccc2c3ccccc3c3c4ccccc4c4ccccc4c3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
EED O75530 1/20 0.43
ROCK1 Q13464 1/20 0.42
TP53 P04637 2/20 0.40
NUDT1 P36639 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
PTK2 Q05397 1/20 0.39
NOTUM Q6P988 1/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL13615919 1.00 OPRM1 (0.44) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13615777 1.00 OPRM1 (0.44) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13615882 0.97 OPRM1 (0.45) OPRM1EEDROCK1TP53NUDT1
SCHEMBL15306247 0.91 OPRM1 (0.45) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13651517 0.85 SRD5A1 (0.38) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13426436 0.82 EED (0.48) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13651450 0.82 SRD5A1 (0.40) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13339228 0.81 OPRM1 (0.38) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13426500 0.81 EED (0.40) OPRM1EEDROCK1TP53NUDT1
SCHEMBL13426442 0.80 ROCK1 (0.39) OPRM1EEDROCK1TP53NUDT1

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-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 US disclosed
US-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 US disclosed
EP-2112214-A1 Dibenzo[g,p]chrysene derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-10-28 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-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 OPRM1 26/4885EED 39/4885ROCK1 2006/4885

“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.