SCHEMBL22945598

SCHEMBL22945598

c1ccc2c3c(ccc2c1)-c1cccc2cccc(c12)N3c1nc(-c2cccc3c2oc2ccccc23)c2ccccc2n1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.35
PRKDC P78527 3/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
CDK2 P24941 1/20 0.31
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 3/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
HPGD P15428 3/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 2/20 0.30
PDE6D O43924 1/20 0.30
GAA P10253 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ADK P55263 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
SCHEMBL22945597 0.90 L3MBTL1 (0.32) KDM4EALDH1A1L3MBTL1HPGDLMNA
SCHEMBL21515427 0.90 PRKDC (0.35) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL22944779 0.88 ALOX5 (0.35) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL22945591 0.88 ALOX5 (0.32) ALOX5PRKDCPIK3CDPIK3CB
SCHEMBL22944714 0.87 PRKDC (0.33) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL22945979 0.86 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL22945608 0.86 ALOX5 (0.35) ALOX5PRKDCPIK3CDPIK3CBCDK2
SCHEMBL22945619 0.86 ALOX5 (0.35) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL22945603 0.85 L3MBTL1 (0.34) KDM4EALDH1A1L3MBTL1HPGDLMNA
SCHEMBL22945126 0.85 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBKDM4E

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 ALOX5 386/4885PRKDC 4810/4885PIK3CD 4301/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 ALOX5 386/4885PRKDC 4810/4885PIK3CD 4301/4885

“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.