SCHEMBL22945447

SCHEMBL22945447

c1ccc(-c2ccc(-c3nc(-c4ccc(N5c6ccc7ccccc7c6-c6cccc7cccc5c67)cc4)nc4ccccc34)cc2)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
ATM Q13315 1/20 0.37
METAP1 P53582 10/20 0.35
DHODH Q02127 1/20 0.34
MAPT P10636 4/20 0.33
PPP1CA P62136 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HIF1A Q16665 1/20 0.33
MAPK1 P28482 3/20 0.33
HSD17B10 Q99714 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL21515465 0.90 PDE6D (0.41) PDE6DKMT2AMEN1ATMMETAP1
SCHEMBL22945005 0.89 ALDH1A1 (0.37) PDE6DKMT2AATMMETAP1DHODH
SCHEMBL22945686 0.86 PDE6D (0.38) PDE6DKMT2AMEN1ATMMETAP1
SCHEMBL22945229 0.85 PDE6D (0.32) PDE6DKMT2AMEN1MAPTMAPK1
SCHEMBL22944784 0.84 KRAS (0.35) PDE6DTGFBR1
SCHEMBL21515283 0.83 PDE6D (0.37) PDE6DKMT2AMEN1ATMALDH1A1
SCHEMBL21515279 0.83 METAP1 (0.39) KMT2AMEN1METAP1MAPTPPP1CA
SCHEMBL22945727 0.83 TGFBR1 (0.38) METAP1MAPTL3MBTL1MAPK1HSD17B10
SCHEMBL22945340 0.81 PDE6D (0.40) PDE6DKMT2AMEN1ATMMETAP1
SCHEMBL22945957 0.81 PDE6D (0.49) PDE6DKMT2AMEN1MAPTTDP1

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 342/4885KMT2A 1519/4885MEN1 1827/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885KMT2A 1519/4885MEN1 1827/4885

“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.