SCHEMBL22479877

SCHEMBL22479877

c1ccc(-c2cc(-c3ccccc3)cc(-n3c4cc5c(cc4c4c6ccccc6ccc43)c3ccccc3n5-c3nc4ccccc4nc3-c3ccccc3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.33
CASP1 P29466 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
DHODH Q02127 1/20 0.32
PTGES O14684 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.31
PDE10A Q9Y233 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
GSR P00390 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
SCHEMBL21742474 0.93 PDE10A (0.33) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL21168714 0.93 KDM4E (0.37) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL21168727 0.93 KDM4E (0.37) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL21168719 0.93 DHODH (0.35) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL19507697 0.93 KDM4E (0.38) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL16838876 0.93 KDM4E (0.38) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL21168736 0.91 KDM4E (0.35) HSD17B10CASP1HRH4PTGESKDM4E
SCHEMBL21168742 0.91 KDM4E (0.35) HSD17B10CASP1HRH4PTGESKDM4E
SCHEMBL21168733 0.90 HPGD (0.34) HSD17B10CASP1HRH4DHODHPTGES
SCHEMBL21168732 0.90 HPGD (0.34) HSD17B10CASP1HRH4DHODHPTGES

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-11758802-B2 Composition and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-12 US disclosed
US-11758802-B2 Composition and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-12 US disclosed
US-20200313095-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-10-01 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-20200313095-A1 COMPOSITION AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CYBA HSD17B10 1587/4885CASP1 1914/4885HRH4 4681/4885
US-11758802-B2 Composition and organic light-emitting device including the same CRY1, CRY2, CYBA HSD17B10 1587/4885CASP1 1914/4885HRH4 4681/4885

“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.