SCHEMBL21735876

SCHEMBL21735876

c1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5cc6ccccc6cc54)nc4sc5ccccc5c34)c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL21735898 0.95 ELANE (0.31) ELANEKDM4ETSHRHSD17B10
SCHEMBL20670041 0.94 NPY5R (0.33) ELANEKDM4ETSHRHSD17B10
SCHEMBL18961936 0.90
SCHEMBL18961924 0.90
SCHEMBL21736050 0.89 TUBB4A (0.36) ELANE
SCHEMBL23983807 0.89 ELANE (0.31) ELANE
SCHEMBL21735999 0.88 KDM4E (0.36) KDM4E
SCHEMBL21736365 0.88 KDM4E (0.36) KDM4E
SCHEMBL21735918 0.88 ALDH1A1 (0.32) ELANE
SCHEMBL21736196 0.88 ELANE (0.31) ELANE

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 ELANE 4654/4885KDM4E 1417/4885TSHR 4719/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 ELANE 4654/4885KDM4E 1417/4885TSHR 4719/4885

“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.