SCHEMBL22945644

SCHEMBL22945644

c1ccc(-n2c3ccccc3c3cc(-c4nc(-c5ccc(N6c7cc8ccccc8cc7-c7cccc8cccc6c78)cc5)nc5c4oc4ccccc45)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.34
TSHR P16473 4/20 0.33
ALDH1A1 P00352 5/20 0.33
LMNA P02545 5/20 0.33
KMT2A Q03164 4/20 0.33
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 3/20 0.33
MAPT P10636 8/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPK1 P28482 1/20 0.32
POLB P06746 3/20 0.32
HPGD P15428 2/20 0.32
NPSR1 Q6W5P4 2/20 0.31
GAA P10253 1/20 0.31
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL22945432 0.95 PDE6D (0.35) PDE6DTSHRALDH1A1LMNAKMT2A
SCHEMBL22945173 0.90 PDE6D (0.31) PDE6D
SCHEMBL22944822 0.90 PDE6D (0.32) PDE6DTSHRALDH1A1LMNAKMT2A
SCHEMBL22945649 0.90 PDE6D (0.32) PDE6DTSHRALDH1A1LMNAKMT2A
SCHEMBL22945639 0.89 PDE6D (0.30) PDE6DTSHR
SCHEMBL22945710 0.87 PRKDC (0.35) PDE6DTSHRALDH1A1LMNAKMT2A
SCHEMBL22945161 0.86 PDE6D (0.31) PDE6D
SCHEMBL22944941 0.85 PDE6D (0.32) PDE6DALDH1A1KDM4E
SCHEMBL22945937 0.85 PDE6D (0.33) PDE6DTSHRALDH1A1LMNAKMT2A
SCHEMBL21736354 0.84 TSHR (0.40) TSHRALDH1A1LMNAKMT2AKDM4E

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 342/4885TSHR 716/4885ALDH1A1 271/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885TSHR 716/4885ALDH1A1 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.