SCHEMBL1102952

SCHEMBL1102952

c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccncc23)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
KDM4E B2RXH2 3/20 0.47
LMNA P02545 2/20 0.47
PKM P14618 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
KLF5 Q13887 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP17A1 P05093 1/20 0.45
CYP19A1 P11511 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
MAPK9 P45984 4/20 0.41
MAPK10 P53779 4/20 0.41
CYP2A6 P11509 1/20 0.41
DCTPP1 Q9H773 1/20 0.40
TDO2 P48775 2/20 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
SCHEMBL1102481 0.90 CYP11B1 (0.54) KDM4ECYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL1102635 0.90 CYP11B1 (0.54) KDM4ECYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL24662785 0.90 KDM4E (0.55) MAPTKDM4ELMNAPKMSMN1; SMN2
SCHEMBL1102895 0.88 CYP11B1 (0.53) KDM4ECYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL1102717 0.88 CYP11B2 (0.57) CYP17A1CYP19A1CYP11B1CYP11B2MAPK9
SCHEMBL1102950 0.88 CYP11B2 (0.57) CYP17A1CYP19A1CYP11B1CYP11B2MAPK9
SCHEMBL1103677 0.88 CYP11B1 (0.56) KDM4ECYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL1102656 0.88 CYP11B1 (0.44) KDM4ECYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL12886839 0.87 MAPT (0.39) MAPTKDM4ELMNAPKMSMN1; SMN2
SCHEMBL1102685 0.87 CYP11B1 (0.51) CYP17A1CYP19A1CYP11B1CYP11B2MAPK9

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 MAPT 3162/4885KDM4E 3367/4885LMNA 2738/4885

“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.