SCHEMBL22456522

SCHEMBL22456522

CP(=O)(c1ccccc1)c1ccc2c(c1)c1ccccc1c1nc3ccc4ccccc4c3n21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.35
MAPT P10636 5/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ESR1 P03372 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
PTGES O14684 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
GAA P10253 2/20 0.32
AHR P35869 2/20 0.32
HTT P42858 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
PDE10A Q9Y233 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31

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
SCHEMBL22456738 0.90 KDM4E (0.34) KDM4EMAPTLMNATP53POLB
SCHEMBL22456791 0.84 KDM4E (0.49) KDM4EMAPTLMNATP53POLB
SCHEMBL22456524 0.82 KDM4E (0.45) KDM4EMAPTLMNATP53POLB
SCHEMBL22456733 0.81 PTGES (0.33) KDM4EMAPTMEN1KMT2APTGES
SCHEMBL22456739 0.79 ESR1 (0.33) KDM4EMAPTLMNATP53POLB
SCHEMBL22456536 0.78 KDM4E (0.48) KDM4EMAPTLMNATP53POLB
SCHEMBL22456732 0.77 KDM4E (0.41) KDM4EMAPTLMNATP53POLB
SCHEMBL22456734 0.77 KDM4E (0.33) KDM4EMAPTLMNATP53POLB
SCHEMBL22456793 0.77 KDM4E (0.49) KDM4EMAPTLMNATP53POLB
SCHEMBL19959980 0.76 KDM4E (0.38) KDM4EMAPTLMNATP53POLB

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
US-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2020-09-24 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 (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-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME NR2E3, NR2E1, NOX1 KDM4E 2372/4885MAPT 4532/4885LMNA 1304/4885

“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.