SCHEMBL21990766

SCHEMBL21990766

C/C=C(\C)C1N(C)c2ccccc2N1c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.34
▸ PDGFRB P09619 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.30
▸ ABCB11 O95342 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ PTPN2 P17706 1/20 0.30
▸ PTPN1 P18031 1/20 0.30

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
SCHEMBL29843820 0.79 HDAC4 (0.37) MAPTPOLBGAA
Iodide SCHEMBL2347798 0.78 HDAC4 (0.36) MAPTPOLBGAA
Iodide SCHEMBL2347792 0.78 HDAC4 (0.36) MAPTPOLBGAA
SCHEMBL16711487 0.71 GAA (0.44) PDGFRBKDM4ELMNAPOLBGAA
SCHEMBL11941264 0.71 GAA (0.44) PDGFRBKDM4ELMNAPOLBGAA
SCHEMBL24398363 0.71 GAA (0.44) PDGFRBKDM4ELMNAPOLBGAA
SCHEMBL1928882 0.69 PDGFRB (0.34) PDGFRBKDM4ELMNAPOLBGAA
SCHEMBL26298275 0.69 PDGFRB (0.34) PDGFRBKDM4ELMNAPOLBGAA
SCHEMBL28138836 0.69 POLB (0.35) PDGFRBLMNAPOLBGAAPTPN2
SCHEMBL28283765 0.66 HDAC4 (0.43) MAPTPDGFRBKDM4EPTPN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2982729-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2020-05-13 — — EP disclosed
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