SCHEMBL9612385

SCHEMBL9612385

c1ccc(-n2c(-c3c4ccccc4c(-c4cc5ccccc5c5cc6ccccc6cc45)c4ccccc34)nc3ccccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.45
MAPK1 P28482 2/20 0.44
HTT P42858 1/20 0.44
ESR2 Q92731 4/20 0.42
ESR1 P03372 3/20 0.42
RPS6KB1 P23443 2/20 0.41
PRKACA P17612 1/20 0.41
GSK3B P49841 1/20 0.41
ROCK1 Q13464 1/20 0.41
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
TLR9 Q9NR96 1/20 0.39
GSR P00390 2/20 0.38
RAB9A P51151 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
GRIA1 P42261 1/20 0.36
CACNG8 Q8WXS5 1/20 0.36

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
SCHEMBL26344961 0.94 RECQL (0.48) RECQLMAPK1HTTESR2ESR1
SCHEMBL9612571 0.91 ESR1 (0.47) RECQLMAPK1HTTESR2ESR1
SCHEMBL9612370 0.90 RECQL (0.45) RECQLMAPK1HTTESR2ESR1
SCHEMBL26344091 0.86 RECQL (0.52) RECQLMAPK1HTTESR2ESR1
SCHEMBL13249058 0.85 ESR1 (0.51) RECQLMAPK1HTTESR2ESR1
SCHEMBL24811909 0.84 ESR1 (0.50) RECQLMAPK1HTTESR2ESR1
SCHEMBL12144410 0.84 RECQL (0.44) RECQLMAPK1HTTESR2ESR1
SCHEMBL12107125 0.84 MAPK1 (0.54) RECQLMAPK1HTTESR2ESR1
SCHEMBL9612363 0.83 ESR1 (0.46) RECQLMAPK1HTTESR2ESR1
SCHEMBL26344100 0.82 ESR1 (0.48) RECQLMAPK1HTTESR2ESR1

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-8986852-B2 Benzanthracene derivatives for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-24 US disclosed
US-8986852-B2 Benzanthracene derivatives for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-24 US disclosed
EP-2148909-B1 BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-05-30 EP disclosed
US-20100187505-A1 BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES IDEMITSU KOSAN CO., LTD. (JP) 2010-07-29 US disclosed
US-20100187505-A1 BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES IDEMITSU KOSAN CO., LTD. (JP) 2010-07-29 US disclosed
WO-2008145239-A2 BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2008-12-04 WO 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-20100187505-A1 BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES KCNT1, KCNC1, TMEM109 RECQL 2340/4885MAPK1 458/4885HTT 614/4885

“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.