SCHEMBL20180764

SCHEMBL20180764

c1ccc(B2N(c3ccccc3)B(c3cccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)c3)N(c3ccccc3)N2c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 2/20 0.44
KDM4E B2RXH2 1/20 0.44
KMT2A Q03164 2/20 0.33
IL1R1 P14778 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
PDE10A Q9Y233 1/20 0.32
FAAH O00519 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PKM P14618 1/20 0.31
MGLL Q99685 1/20 0.31
HTR1A P08908 1/20 0.30
HTR7 P34969 1/20 0.30
FOLH1 Q04609 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
SCHEMBL20180646 0.93 L3MBTL1 (0.47) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL20734362 0.84 L3MBTL1 (0.41) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL20734360 0.83 L3MBTL1 (0.55) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL20180734 0.83 FAAH (0.32) ATMALDH1A1HTTFAAHHSP90AA1
SCHEMBL20734357 0.82 L3MBTL1 (0.50) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL20734253 0.82 L3MBTL1 (0.53) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL20734430 0.80 L3MBTL1 (0.45) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL29598680 0.78 ATM (0.65) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL29518761 0.78 ATM (0.65) L3MBTL1ATMKDM4EKMT2AIL1R1
SCHEMBL12362772 0.78 ATM (0.65) L3MBTL1ATMKDM4EKMT2AIL1R1

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
US-20180226580-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-08-09 US disclosed
US-20180145264-A1 Organic Electroluminescent Device; A Charge Transporting Material For The Organic Electroluminescent Device; And A Luminescent Device, A Display Device And A Lighting System Using The Organic Electroluminescent Device UDC IRELAND LTD (IE) 2018-05-24 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 (2 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-20180145264-A1 Organic Electroluminescent Device; A Charge Transporting Material For The Organic Electroluminescent Device; And A Luminescent Device, A Display Device And A Lighting System Using The Organic Electroluminescent Device SLC43A1, SLC6A19, AOC3 L3MBTL1 871/4885ATM 4294/4885KDM4E 3013/4885
US-20180226580-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES SLCO4C1, SLCO2A1, SLCO2B1 L3MBTL1 1634/4885ATM 4617/4885KDM4E 3981/4885

“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.