SCHEMBL21717020

SCHEMBL21717020

c1cc(-c2nc3ccccc3nc2-c2ccc3c(ccc4ccccc43)c2)cc(-n2c3ccccc3c3cc4c(-n5c6ccccc6c6ccc7ccccc7c65)cccc4cc32)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.34
TDP1 Q9NUW8 1/20 0.33
PDE10A Q9Y233 2/20 0.32
GAA P10253 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PDPK1 O15530 8/20 0.32
RAD51 Q06609 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 2/20 0.30
LMNA P02545 2/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
NPY1R P25929 1/20 0.30
HTT P42858 1/20 0.30
NPY2R P49146 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
SCHEMBL21716285 0.95 KDM4E (0.34) GSRTDP1PDE10AGAAMEN1
SCHEMBL21716819 0.95 GSR (0.36) GSRTDP1PDE10AGAAMEN1
SCHEMBL21717019 0.93 TDP1 (0.33) GSRTDP1PDE10AGAAMEN1
SCHEMBL21716265 0.93 GSR (0.39) GSRTDP1PDE10AGAAMEN1
SCHEMBL21716391 0.91 MEN1 (0.35) GAAMEN1KMT2APDPK1ATM
SCHEMBL21716903 0.90 GSR (0.33) GSRTDP1RAD51ALDH1A1LMNA
SCHEMBL21717179 0.89 KDM4E (0.31) GSRPDE10AGAAMEN1KMT2A
SCHEMBL21717122 0.88 GSR (0.37) GSRTDP1PDE10APDPK1RAD51
SCHEMBL21716831 0.87 L3MBTL1 (0.38) GSRTDP1GAAMEN1KMT2A
SCHEMBL21717068 0.87 GSR (0.34) GSRTDP1KDM4EATML3MBTL1

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-11192884-B2 Heterocyclic compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2021-12-07 US disclosed
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-13 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-11192884-B2 Heterocyclic compound and organic light-emitting device comprising same CYP1A1, CYP1B1, CRY1 GSR 3951/4885TDP1 1382/4885PDE10A 3123/4885
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CYP1B1, CRY1 GSR 3951/4885TDP1 1382/4885PDE10A 3123/4885

“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.