SCHEMBL17524717

SCHEMBL17524717

OB(O)c1cccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
ATM Q13315 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MGLL Q99685 1/20 0.41
ENPP2 Q13822 5/20 0.40
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
MAPK8 P45983 2/20 0.35
KMT2A Q03164 2/20 0.35
VCP P55072 2/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPK9 P45984 1/20 0.35
DUSP3 P51452 1/20 0.35
FOLH1 Q04609 1/20 0.34
PLA2G2A P14555 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL19538158 0.92 MGLL (0.51) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL8819304 0.88 KDM4E (0.49) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL29366317 0.88 KDM4E (0.53) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL804836 0.88 KDM4E (0.53) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL16978835 0.87 L3MBTL1 (0.50) KDM4EATML3MBTL1MAPK8KMT2A
SCHEMBL16381824 0.86 MGLL (0.39) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL19176496 0.85 KDM4E (0.53) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL16381800 0.85 KDM4E (0.36) KDM4EATML3MBTL1MGLLENPP2
SCHEMBL2754634 0.84 L3MBTL1 (0.63) KDM4EATML3MBTL1MAPK8KMT2A
SCHEMBL17448902 0.84 L3MBTL1 (0.47) KDM4EATML3MBTL1MAPK8KMT2A

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-9876181-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-01-23 US disclosed
US-9876181-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-01-23 US disclosed
US-20170237017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-08-17 US disclosed
US-20170237017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-08-17 US disclosed
WO-2016023608-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-02-18 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-20170237017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES DDT, ETFA, TST KDM4E 1629/4885ATM 4129/4885L3MBTL1 1145/4885

“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.