SCHEMBL22945676

SCHEMBL22945676

c1ccc(-n2c3ccccc3c3c(-c4nc(N5c6c(ccc7ccccc67)-c6cccc7cccc5c67)nc5c4oc4ccccc45)cccc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TP53 P04637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 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
SCHEMBL22944942 0.91 ALDH1A1 (0.31) ALDH1A1TP53L3MBTL1POLB
SCHEMBL22944827 0.90
SCHEMBL22945431 0.89
SCHEMBL22945677 0.89 SIRT2 (0.30) ALDH1A1TP53SIRT2SIRT1
SCHEMBL22945150 0.89 SIRT2 (0.30) ALDH1A1TP53SIRT2SIRT1
SCHEMBL22945171 0.88 ALDH1A1 (0.32) ALDH1A1TP53L3MBTL1
SCHEMBL22946126 0.86 CREBBP (0.31) ALDH1A1L3MBTL1
SCHEMBL22945636 0.86 PIM1 (0.32) ALDH1A1TP53L3MBTL1POLB
SCHEMBL22944779 0.85 ALOX5 (0.35) ALDH1A1L3MBTL1
SCHEMBL21515418 0.85 TSHR (0.36) ALDH1A1POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-04 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-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, DRD3, DRD2 ALDH1A1 271/4885TP53 4333/4885L3MBTL1 339/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 ALDH1A1 271/4885TP53 4333/4885L3MBTL1 339/4885

“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.