SCHEMBL21735864

SCHEMBL21735864

c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2ccc3ccc4ccccc4c3c2)nc2oc3ccccc3c12

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHEK2 O96017 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ABCG2 Q9UNQ0 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
SCHEMBL21735901 0.93 CHEK2 (0.31) L3MBTL1CHEK2LMNASMN1; SMN2ALDH1A1
SCHEMBL24772668 0.93 CHEK2 (0.37) L3MBTL1CHEK2LMNASMN1; SMN2ALDH1A1
SCHEMBL21736151 0.91 TDP1 (0.33) TDP1L3MBTL1LMNASMN1; SMN2ALDH1A1
SCHEMBL20669988 0.91 HCRTR1 (0.33) L3MBTL1CHEK2LMNASMN1; SMN2ALDH1A1
SCHEMBL21736293 0.90 SMN1; SMN2 (0.38) L3MBTL1CHEK2LMNASMN1; SMN2ALDH1A1
SCHEMBL21735860 0.89 TSHR (0.37) L3MBTL1LMNASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL20670060 0.88 SMN1; SMN2 (0.38) L3MBTL1LMNASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL21735869 0.88 TSHR (0.33) LMNASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL21736039 0.87 GRM4 (0.34) ALDH1A1
SCHEMBL20670116 0.87

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 TDP1 2242/4885L3MBTL1 433/4885CHEK2 3750/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 TDP1 2242/4885L3MBTL1 433/4885CHEK2 3750/4885

“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.