SCHEMBL1102702

SCHEMBL1102702

c1ccc(-c2c3ccccc3c(-c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cnccc23)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.60
TNF P01375 1/20 0.50
ALOX5 P09917 1/20 0.47
GPR84 Q9NQS5 3/20 0.44
KDM4E B2RXH2 5/20 0.43
HTT P42858 2/20 0.43
POLB P06746 1/20 0.43
RAD52 P43351 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
MPI P34949 1/20 0.41
HIPK2 Q9H2X6 3/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
CYP11B2 P19099 1/20 0.40
HASPIN Q8TF76 1/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40

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
SCHEMBL1102549 0.93 CYP11B1 (0.58) CYP11B1TNFALOX5GPR84KDM4E
SCHEMBL1102645 0.87 TNF (0.51) CYP11B1TNFALOX5GPR84KDM4E
SCHEMBL23341630 0.86 MEN1 (0.53) CYP11B1ALOX5GPR84KDM4EMEN1
SCHEMBL1102751 0.84 TNF (0.54) CYP11B1TNFALOX5KDM4EHPGD
SCHEMBL1102547 0.84 CYP11B1 (0.57) CYP11B1TNFALOX5GPR84KDM4E
SCHEMBL1103685 0.84 CYP11B1 (0.57) CYP11B1TNFALOX5GPR84KDM4E
SCHEMBL1102806 0.84 TNF (0.47) TNFALOX5KDM4EHTTPOLB
SCHEMBL1102798 0.84 TNF (0.47) TNFALOX5KDM4EHTTPOLB
SCHEMBL1102677 0.84 TNF (0.47) TNFALOX5KDM4EHTTPOLB
SCHEMBL1102900 0.84 TNF (0.47) TNFALOX5KDM4EHTTPOLB

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 CYP11B1 836/4885TNF 3803/4885ALOX5 9/4885

“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.