SCHEMBL22945682

SCHEMBL22945682

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(N5c6ccccc6-c6cccc7cccc5c67)c4)n3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.52
ALDH1A1 P00352 5/20 0.37
ATM Q13315 2/20 0.37
FAAH O00519 1/20 0.37
HSP90AA1 P07900 1/20 0.37
PKM P14618 1/20 0.37
HTT P42858 1/20 0.37
MGLL Q99685 1/20 0.37
HPGD P15428 3/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
TSHR P16473 4/20 0.34
ADORA2A P29274 2/20 0.34
TP53 P04637 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 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
SCHEMBL24254086 0.93 PDE6D (0.43) PDE6DALDH1A1ATMFAAHHSP90AA1
SCHEMBL21515304 0.91 PDE6D (0.63) PDE6DALDH1A1ATMFAAHMGLL
SCHEMBL22945538 0.89 PDE6D (0.43) PDE6DALDH1A1ATMFAAHHSP90AA1
SCHEMBL22945569 0.87 PDE6D (0.40) PDE6DALDH1A1ATMPKMHPGD
SCHEMBL22946055 0.86 PDE6D (0.54) PDE6DALDH1A1ATMHTTMGLL
SCHEMBL16884808 0.85 ALDH1A1 (0.41) PDE6DALDH1A1ATMFAAHHSP90AA1
SCHEMBL22945214 0.85 PDE6D (0.39) PDE6DALDH1A1ATMPKMHPGD
SCHEMBL24254012 0.85 PDE6D (0.55) PDE6DALDH1A1ATMMGLLHPGD
SCHEMBL21515566 0.84 PDE6D (0.38) PDE6DMEN1KMT2AADORA2AADORA1
SCHEMBL21515570 0.83 PDE6D (0.37) PDE6DALDH1A1ATMHPGDMAPT

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 271/4885ATM 2003/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885ALDH1A1 271/4885ATM 2003/4885

“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.