SCHEMBL21732767

SCHEMBL21732767

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5ccc6c(c5)Oc5ccccc5C6(c5ccccc5)c5ccccc5)c4)c3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
CYP19A1 P11511 1/20 0.35
MEN1 O00255 4/20 0.35
ADORA3 P0DMS8 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
MYC P01106 1/20 0.34
AKT1 P31749 1/20 0.34
AKT2 P31751 1/20 0.34
AKT3 Q9Y243 1/20 0.34
MCL1 Q07820 2/20 0.33
RAB9A P51151 1/20 0.33
BACE1 P56817 1/20 0.32
LMNA P02545 2/20 0.32
GLA P06280 1/20 0.32
CTRC Q99895 1/20 0.32

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
SCHEMBL21732759 1.00 KMT2A (0.35) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732757 0.96 KMT2A (0.37) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732760 0.96 CYP19A1 (0.37) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732766 0.94 KMT2A (0.38) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732541 0.94 KMT2A (0.38) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL25453369 0.91 KMT2A (0.37) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732776 0.90 KMT2A (0.40) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732764 0.90 CYP19A1 (0.38) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL25453502 0.90 CYP19A1 (0.40) KMT2AKDM4EALDH1A1MAPTHPGD
SCHEMBL21732774 0.89 MEN1 (0.40) KMT2AKDM4EALDH1A1MAPTHPGD

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-20210053934-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2021-02-25 US disclosed
WO-2020036314-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME 주식회사 엘지화학 2020-02-20 WO 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-20210053934-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME AOX1, CRY1, ALDH1A2 KMT2A 1854/4885KDM4E 2872/4885ALDH1A1 5/4885

“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.