SCHEMBL21736613

SCHEMBL21736613

c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3c2oc2ccccc23)c2c(n1)oc1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
PRKDC P78527 5/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
CDK2 P24941 1/20 0.32
ATM Q13315 1/20 0.31
ADK P55263 1/20 0.30
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21736498 0.91 SMN1; SMN2 (0.32) LMNASMN1; SMN2
SCHEMBL23983793 0.88 ALOX5 (0.33) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL20669796 0.88 ALDH1A1 (0.32) LMNASMN1; SMN2
SCHEMBL23026921 0.88 ALOX5 (0.33) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21735875 0.87 KDM4E (0.34) PRKDCLMNASMN1; SMN2
SCHEMBL21735880 0.86 SMN1; SMN2 (0.32) LMNASMN1; SMN2
SCHEMBL18961955 0.86 ALOX5 (0.32) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL21213731 0.85 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL21736208 0.85 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL21736303 0.85 SMN1; SMN2 (0.37) ATMLMNASMN1; SMN2

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 ALOX5 599/4885PRKDC 4766/4885PIK3CD 4544/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 ALOX5 599/4885PRKDC 4766/4885PIK3CD 4544/4885

“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.