SCHEMBL21736008

SCHEMBL21736008

c1ccc(-c2ccc3oc4nc(-c5cccc6c5c5ccccc5n6-c5ccccc5)nc(-n5c6ccccc6c6cc7ccccc7cc65)c4c3c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
PIM1 P11309 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL21736376 0.91 SMN1; SMN2 (0.37) SMN1; SMN2LMNAKDM4EATML3MBTL1
SCHEMBL21736055 0.90 SMN1; SMN2 (0.34) SMN1; SMN2LMNAKDM4EATML3MBTL1
SCHEMBL21736240 0.87 SIRT2 (0.32) SMN1; SMN2LMNAKDM4EATML3MBTL1
SCHEMBL21736065 0.87 TBK1 (0.34) SMN1; SMN2LMNAKDM4EL3MBTL1PIM1
SCHEMBL21736028 0.85 PIM1 (0.34) SMN1; SMN2LMNAKDM4EATML3MBTL1
SCHEMBL21736073 0.85 ALDH1A1 (0.34) SMN1; SMN2KDM4EATML3MBTL1ALDH1A1
SCHEMBL21736293 0.84 SMN1; SMN2 (0.38) SMN1; SMN2LMNAKDM4EATML3MBTL1
SCHEMBL21736372 0.83 PIM1 (0.34) SMN1; SMN2LMNAKDM4EATML3MBTL1
SCHEMBL24779250 0.82 SMN1; SMN2 (0.34) SMN1; SMN2LMNASIRT2SIRT1ALDH1A1
SCHEMBL20670060 0.82 SMN1; SMN2 (0.38) SMN1; SMN2LMNAKDM4EATML3MBTL1

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-11530225-B2 Compound and organic light-emitting diode comprising same LG CHEM, LTD. (KR) 2022-12-20 US disclosed
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-20 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-11530225-B2 Compound and organic light-emitting diode comprising same CRY1, CRY2, TRPA1 SMN1; SMN2 1814/4885LMNA 3949/4885KDM4E 1417/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 SMN1; SMN2 1814/4885LMNA 3949/4885KDM4E 1417/4885

“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.