SCHEMBL22945139

SCHEMBL22945139

c1ccc(-c2nc(-c3cccc4c(N5c6cc7ccccc7cc6-c6cccc7cccc5c67)cccc34)nc3ccccc23)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 7/20 0.39
MAPT P10636 7/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 5/20 0.39
LMNA P02545 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
MAPK1 P28482 4/20 0.37
RAB9A P51151 4/20 0.37
TDP1 Q9NUW8 3/20 0.37
KMT2A Q03164 3/20 0.37
TSHR P16473 2/20 0.37
ABCB1 P08183 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL21515438 0.92 METAP1 (0.42) METAP1MAPTALDH1A1POLBL3MBTL1
SCHEMBL22945518 0.88 METAP1 (0.38) METAP1MAPTALDH1A1POLBL3MBTL1
SCHEMBL22945340 0.87 PDE6D (0.40) METAP1MAPTALDH1A1POLBL3MBTL1
SCHEMBL22945153 0.85 METAP1 (0.39) METAP1MAPTALDH1A1POLBL3MBTL1
SCHEMBL21515279 0.85 METAP1 (0.39) METAP1MAPTALDH1A1POLBL3MBTL1
SCHEMBL22945685 0.85 MMP9 (0.33) ALDH1A1KMT2AHPGDGAAMEN1
SCHEMBL22945011 0.83 KRAS (0.38) MAPTALDH1A1MAPK1HSD17B10KDM4E
SCHEMBL22945183 0.83 NPC1 (0.34) MAPTALDH1A1LMNAMAPK1RAB9A
SCHEMBL22945686 0.83 PDE6D (0.38) METAP1MAPTALDH1A1POLBL3MBTL1
SCHEMBL21515466 0.78 METAP1 (0.39) METAP1MAPTALDH1A1L3MBTL1LMNA

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 METAP1 4244/4885MAPT 2771/4885ALDH1A1 271/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 METAP1 4244/4885MAPT 2771/4885ALDH1A1 271/4885

“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.