SCHEMBL22945404

SCHEMBL22945404

c1ccc(-c2nc(-c3ccc4c(c3)sc3ccccc34)nc(N3c4ccccc4-c4cccc5cccc3c45)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.39
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
RAB9A P51151 1/20 0.32
F9 P00740 1/20 0.32
ALOX5 P09917 1/20 0.32
SLC9A1 P19634 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL22945203 0.99 PDE6D (0.40) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22945201 0.95 PDE6D (0.37) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22944936 0.94 PDE6D (0.34) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22945179 0.94 PDE6D (0.39) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22945334 0.93 PDE6D (0.37) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL26736444 0.93 PDE6D (0.46) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22945977 0.92 PDE6D (0.38) PDE6DALDH1A1HPGDTP53TSHR
SCHEMBL26736467 0.92 PDE6D (0.37) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL26736481 0.92 PDE6D (0.37) PDE6DALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL22945202 0.91 ALOX5 (0.39) PDE6DALDH1A1MAPTHPGDSMN1; 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 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 PDE6D 342/4885ALDH1A1 271/4885MAPT 2771/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885ALDH1A1 271/4885MAPT 2771/4885

“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.