SCHEMBL1102522

SCHEMBL1102522

c1ccc(-c2cc(-c3c4ccccc4c(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)c4cnccc34)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.53
TNF P01375 1/20 0.44
DHODH Q02127 2/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
ACHE P22303 1/20 0.41
MAPK10 P53779 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
RAD52 P43351 1/20 0.40
LMNA P02545 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RAB9A P51151 1/20 0.39
CYP11B1 P15538 1/20 0.39

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
SCHEMBL1102533 0.90 CYP19A1 (0.63) CYP19A1DHODHKDM4EALDH1A1MAPT
SCHEMBL1102852 0.89 TNF (0.52) CYP19A1TNFDHODHKDM4EALDH1A1
SCHEMBL1102499 0.84 NOTUM (0.45) CYP19A1TNFDHODHKDM4EALDH1A1
SCHEMBL1102755 0.84 MEN1 (0.47) CYP19A1TNFDHODHKDM4EALDH1A1
SCHEMBL19271319 0.84 MEN1 (0.50) CYP19A1DHODHKDM4EALDH1A1MAPT
SCHEMBL1102490 0.84 TNF (0.48) TNFKDM4EALDH1A1MAPTHPGD
SCHEMBL1102608 0.83 NOTUM (0.43) CYP19A1TNFKDM4EALDH1A1HPGD
SCHEMBL1102806 0.82 TNF (0.47) TNFDHODHKDM4EALDH1A1MAPT
SCHEMBL1102677 0.82 TNF (0.47) TNFDHODHKDM4EALDH1A1MAPT
SCHEMBL1102798 0.82 TNF (0.47) TNFDHODHKDM4EALDH1A1MAPT

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 CYP19A1 1424/4885TNF 3803/4885DHODH 1013/4885

“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.