SCHEMBL29936503

SCHEMBL29936503

O/N=C\c1ccc(-c2cccc(-c3cccc(-c4ccccc4)c3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC1 P78348 2/20 0.54
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KCNH2 Q12809 1/20 0.49
KMT2A Q03164 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 1/20 0.46
GFER P55789 1/20 0.46
MAPT P10636 4/20 0.45
RAB9A P51151 3/20 0.45
MEN1 O00255 2/20 0.45
NPC1 O15118 2/20 0.45
GAA P10253 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
ESR1 P03372 1/20 0.45
LMNA P02545 1/20 0.44
RIPK1 Q13546 2/20 0.43

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
SCHEMBL29936120 1.00 ASIC1 (0.54) ASIC1ALDH1A1KDM4EL3MBTL1KCNH2
SCHEMBL2492354 0.92 KMT2A (0.54) ASIC1ALDH1A1KDM4EL3MBTL1KMT2A
SCHEMBL4686720 0.92 KMT2A (0.54) ASIC1ALDH1A1KDM4EL3MBTL1KMT2A
SCHEMBL2445407 0.92 KMT2A (0.54) ASIC1ALDH1A1KDM4EL3MBTL1KMT2A
SCHEMBL8308133 0.86 KDM4E (0.52) ASIC1ALDH1A1KDM4EL3MBTL1KCNH2
SCHEMBL2164243 0.86 KDM4E (0.52) ASIC1ALDH1A1KDM4EL3MBTL1KCNH2
SCHEMBL2164241 0.86 KDM4E (0.52) ASIC1ALDH1A1KDM4EL3MBTL1KCNH2
SCHEMBL5117035 0.79 PTPN5 (0.47) ASIC1KCNH2
SCHEMBL5117029 0.79 PTPN5 (0.47) ASIC1KCNH2
Benzaldehyde Oxime SCHEMBL220641 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11737348-B2 Halide material and optical unit and optoelectronic device having the same NATIONAL TSING HUA UNIVERSITY (TW) 2023-08-22 US disclosed
US-20220302393-A1 HALIDE MATERIAL AND OPTICAL UNIT AND OPTOELECTRONIC DEVICE HAVING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2022-09-22 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-20220302393-A1 HALIDE MATERIAL AND OPTICAL UNIT AND OPTOELECTRONIC DEVICE HAVING THE SAME MLX, BRIX1, TBL1XR1 ASIC1 2024/4885ALDH1A1 498/4885KDM4E 3067/4885
US-11737348-B2 Halide material and optical unit and optoelectronic device having the same MLX, BRIX1, TBL1XR1 ASIC1 2085/4885ALDH1A1 488/4885KDM4E 3024/4885

“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.