SCHEMBL20710331

SCHEMBL20710331

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cc(-c4ccccc4)cc(-c4ccc5c(c4)-c4ccccc4C54c5ccccc5-c5ccccc54)c3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.39
MAPT P10636 3/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
THRB P10828 2/20 0.36
APAF1 O14727 1/20 0.36
NPC1 O15118 1/20 0.36
XBP1 P17861 1/20 0.36
PTBP1 P26599 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
GALK1 P51570 1/20 0.36
BLM P54132 1/20 0.36
SMAD3 P84022 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL20710355 1.00 PDK2 (0.39) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL25496140 1.00 PDK2 (0.39) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL16424713 0.96 PDK2 (0.38) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL24646690 0.94 PDK2 (0.36) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL15213737 0.94 PDK2 (0.43) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL21923950 0.93 MEN1 (0.39) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL21559449 0.93 PDK2 (0.35) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL17740727 0.93 KDM4E (0.36) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL19168608 0.92 MAPT (0.42) PDK2MAPTMEN1LMNAKMT2A
SCHEMBL19166299 0.92 MAPT (0.42) PDK2MAPTMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3411455-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-10-21 EP disclosed
US-20190040034-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-02-07 US 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-20190040034-A1 MATERIALS FOR ELECTRONIC DEVICES EFNA1, GPX1, EPX PDK2 474/4885MAPT 3100/4885MEN1 306/4885

“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.