SCHEMBL22945456

SCHEMBL22945456

c1ccc2c3c(ccc2c1)N(c1nc(-c2ccc(-c4cccc5cccnc45)cc2)c2oc4ccccc4c2n1)c1cccc2cccc-3c12

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL22945459 0.93 HPGD (0.34) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22945923 0.90 TSHR (0.34) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22945457 0.90 AHR (0.32) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22944744 0.89 PDE6D (0.37) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL22945991 0.89 TSHR (0.35) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22945743 0.89 ALDH1A1 (0.32) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22944778 0.89 KDM4E (0.34) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL22944919 0.87 TSHR (0.32) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22946033 0.87 NPC1 (0.33) HSD17B10
SCHEMBL22944743 0.87 NPC1 (0.34) ALDH1A1MAPTHSD17B10TSHR

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 KDM4E 1857/4885ALDH1A1 271/4885GAA 4342/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 KDM4E 1857/4885ALDH1A1 271/4885GAA 4342/4885

“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.