SCHEMBL13229149

SCHEMBL13229149

c1ccc2cc(-c3cc(-c4cc5ccccc5o4)c4ccc5c(-c6ccc7ccccc7c6)cc(-c6cc7ccccc7o6)c6ccc3c4c56)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.46
MAOA P21397 2/20 0.46
ALOX5 P09917 1/20 0.44
PTPRC P08575 1/20 0.43
PTPN1 P18031 1/20 0.43
KMT2A Q03164 7/20 0.43
MEN1 O00255 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
MIF P14174 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
GSTP1 P09211 1/20 0.41
RAB9A P51151 4/20 0.40
POLB P06746 2/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
PDE4D Q08499 1/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
NPC1 O15118 4/20 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
SCHEMBL13229090 1.00 MAOB (0.46) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13229055 0.96 PTPRC (0.44) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13229158 0.92 ALDH1A1 (0.44) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13229027 0.88 PTPRC (0.47) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL14197898 0.87 MAOB (0.58) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13229188 0.87 CYP26B1 (0.40) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13229095 0.87 KMT2A (0.51) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13229144 0.87 KMT2A (0.51) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL19497661 0.86 KMT2A (0.54) MAOBMAOAALOX5PTPRCPTPN1
SCHEMBL13953716 0.86 KMT2A (0.54) MAOBMAOAALOX5PTPRCPTPN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729530-B2 Material for light-emitting device and light-emitting device TORAY INDUSTRIES, INC. (JP) 2014-05-20 US disclosed
US-8729530-B2 Material for light-emitting device and light-emitting device TORAY INDUSTRIES, INC. (JP) 2014-05-20 US disclosed
EP-2028249-B1 MATERIAL FOR LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES (JP) 2013-05-08 EP disclosed
US-20100163852-A1 Material for light-emitting device and light-emitting device TORAY INDUSTRIES, INC. (JP) 2010-07-01 US disclosed
US-20100163852-A1 Material for light-emitting device and light-emitting device TORAY INDUSTRIES, INC. (JP) 2010-07-01 US disclosed
EP-2028249-A1 MATERIAL FOR LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING DEVICE Toray Industries, Inc. (JP) 2009-02-25 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-20100163852-A1 Material for light-emitting device and light-emitting device CRY1, CRY2, S100A10 MAOB 2776/4885MAOA 2575/4885ALOX5 1466/4885

“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.