SCHEMBL22379840

SCHEMBL22379840

N#Cc1ccc(-n2c3ccccc3c3ccccc32)cc1-c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)cn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
NR3C1 P04150 1/20 0.36
ALDH1A1 P00352 5/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLC6A9 P48067 1/20 0.35
TRPA1 O75762 1/20 0.34
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA3 P34903 2/20 0.33
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
GABRA5 P31644 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ESR2 Q92731 1/20 0.33
GABRA1 P14867 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
SCHEMBL22378779 0.86 ALDH1A1 (0.39) NR3C1ALDH1A1HPGDMAPK1LMNA
SCHEMBL22379402 0.85 ALDH1A1 (0.38) NR3C1ALDH1A1HPGDMAPK1LMNA
SCHEMBL19755259 0.83 KDM4E (0.40) NR3C1ALDH1A1HPGDMAPK1LMNA
SCHEMBL22378619 0.82 KDM4E (0.39) NR3C1ALDH1A1HPGDMAPK1LMNA
SCHEMBL12856697 0.82 ALDH1A1 (0.41) ALOX5APFEN1ALDH1A1LMNAKDM4E
SCHEMBL21396952 0.81 ALDH1A1 (0.39) ALOX5APFEN1NR3C1ALDH1A1HPGD
SCHEMBL22379424 0.81 SMN1; SMN2 (0.40) NR3C1ALDH1A1HPGDMAPK1LMNA
SCHEMBL22378771 0.81 NR3C1 (0.35) ALOX5APFEN1NR3C1ALDH1A1HPGD
SCHEMBL22379330 0.80 KDM4E (0.40) NR3C1ALDH1A1HPGDMAPK1LMNA
SCHEMBL17955024 0.80 ATM (0.39) ALOX5APFEN1NR3C1ALDH1A1SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 US disclosed
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 US disclosed
EP-3702349-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2023-01-04 EP disclosed
US-20200274074-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-08-27 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-20200274074-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CYP1A1, CRY2 ALOX5AP 2179/4885FEN1 1491/4885NR3C1 1012/4885
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same CRY1, CYP1A1, CRY2 ALOX5AP 2179/4885FEN1 1491/4885NR3C1 1012/4885

“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.