SCHEMBL22945338

SCHEMBL22945338

c1ccc(-c2nc(-c3cccc4c3sc3ccccc34)nc(N3c4cc5ccccc5cc4-c4cccc5cccc3c45)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
PDE6D O43924 1/20 0.34
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PRKDC P78527 5/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PARP14 Q460N5 1/20 0.31

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
SCHEMBL22945047 0.95 ALOX5 (0.38) ALOX5PDE6DPRKDCPIK3CDPIK3CB
SCHEMBL22945643 0.92 PDE6D (0.42) ALOX5PDE6DTNKSTNKS2PRKDC
SCHEMBL22945976 0.92 ALOX5 (0.36) ALOX5PRKDCPIK3CDPIK3CBALDH1A1
SCHEMBL22945522 0.92 PDE6D (0.37) ALOX5PDE6DTNKSTNKS2PRKDC
SCHEMBL22945486 0.91 ALOX5 (0.37) ALOX5PDE6DPRKDC
SCHEMBL22945487 0.91 ALOX5 (0.37) ALOX5PDE6DPRKDC
SCHEMBL22945750 0.91 ALOX5 (0.35) ALOX5PRKDCPIK3CDPIK3CBALDH1A1
SCHEMBL22944887 0.89 ALOX5 (0.36) ALOX5PDE6DPRKDCPIK3CDPIK3CB
SCHEMBL22944803 0.89 PDE6D (0.35) PDE6DALDH1A1TP53HPGDTSHR
SCHEMBL22944801 0.88 PDE6D (0.37) ALOX5PDE6DALDH1A1TP53HPGD

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 386/4885PDE6D 342/4885TNKS 4607/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 ALOX5 386/4885PDE6D 342/4885TNKS 4607/4885

“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.