SCHEMBL22945232

SCHEMBL22945232

c1ccc2c(c1)-c1cccc3cccc(c13)N2c1nc(-c2cccc3c2sc2ccccc23)c2sc3ccccc3c2n1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
PRKDC P78527 4/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
PARP14 Q460N5 1/20 0.33
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
ADK P55263 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HTT P42858 1/20 0.30
PAX8 Q06710 1/20 0.30
PDE6D O43924 1/20 0.30
MAPT P10636 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
SCHEMBL22944969 0.92 POLB (0.32) PIM1PIM2HRH4PDE6DMAPT
SCHEMBL22945534 0.92 ALOX5 (0.34) ALOX5PRKDCPIK3CDPIK3CBPARP14
SCHEMBL22945914 0.90 BRDT (0.31) PIM1PIM2HRH4
SCHEMBL22946020 0.90 ALOX5 (0.32) ALOX5PRKDCPIK3CDPIK3CBPARP14
SCHEMBL22945492 0.89 PDE6D (0.37) ALOX5PIM1PIM2HRH4PDE6D
SCHEMBL22945441 0.89 ALOX5 (0.32) ALOX5PRKDCPIK3CDPIK3CBPARP14
SCHEMBL22944980 0.89 PDE6D (0.35) PDE6DMAPT
SCHEMBL22945115 0.88 ALOX5 (0.34) ALOX5PRKDCPIK3CDPIK3CBPARP14
SCHEMBL22944962 0.88 ALDH1A1 (0.36) MAPT
SCHEMBL21515448 0.87 ALOX5 (0.34) ALOX5PRKDCPIK3CDPIK3CBPARP14

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.