SCHEMBL1102804

SCHEMBL1102804

c1ccc(-c2cc3ccccc3cc2-c2c3ccccc3c(-c3cccc4ccccc34)c3ccncc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 3/20 0.59
CYP11B1 P15538 2/20 0.43
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
HPGD P15428 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 2/20 0.42
HASPIN Q8TF76 1/20 0.41
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
GPR84 Q9NQS5 1/20 0.40
ALOX5 P09917 1/20 0.40
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 2/20 0.39
MAPK10 P53779 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
CYP11B2 P19099 1/20 0.39
TP53 P04637 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
SCHEMBL1102489 0.93 TNF (0.54) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102645 0.90 TNF (0.51) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102879 0.90 TNF (0.69) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102665 0.90 TNF (0.64) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102550 0.88 TNF (0.61) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102801 0.87 TNF (0.56) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102675 0.87 TNF (0.60) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102796 0.87 TNF (0.56) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102681 0.87 TNF (0.59) TNFCYP11B1KDM4EALDH1A1MAPT
SCHEMBL1102652 0.87 TNF (0.59) TNFCYP11B1KDM4EALDH1A1MAPT

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 TNF 3803/4885CYP11B1 836/4885KDM4E 3367/4885

“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.