SCHEMBL23601227

SCHEMBL23601227

Brc1ccc(C23CC4CC5CC(C2)C5(C4)C3)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ RAD52 P43351 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.39
▸ GRIN2D O15399 1/20 0.37
▸ GRIN3B O60391 1/20 0.37
▸ GRIN1 Q05586 1/20 0.37
▸ GRIN2A Q12879 1/20 0.37
▸ GRIN2B Q13224 1/20 0.37
▸ GRIN2C Q14957 1/20 0.37
▸ GRIN3A Q8TCU5 1/20 0.37
▸ PGR P06401 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ EPHX2 P34913 1/20 0.33
▸ ESR1 P03372 1/20 0.33

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
SCHEMBL23600820 0.96 MEN1 (0.48) MEN1KMT2ARAD52ALDH1A1GRIN2D
SCHEMBL23600756 0.81 GRIN2D (0.37) MEN1KMT2ARAD52ALDH1A1GRIN2D
SCHEMBL19098273 0.81 LMNA (0.48) MEN1KMT2ARAD52ALDH1A1GRIN2D
SCHEMBL19089897 0.81 LMNA (0.48) MEN1KMT2ARAD52ALDH1A1GRIN2D
SCHEMBL14804287 0.79 MEN1 (0.68) MEN1KMT2ARAD52ALDH1A1GRIN2D
SCHEMBL14342028 0.79 CA9 (0.44) MEN1KMT2ARAD52ALDH1A1GRIN2D
SCHEMBL25911451 0.77 EPHX2 (0.43) MEN1KMT2AALDH1A1GRIN2DGRIN3B
SCHEMBL23194820 0.76 GRIN2D (0.40) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14342029 0.76 NPC1 (0.64) MEN1KMT2AALDH1A1PGRLMNA
SCHEMBL23206304 0.76 GRIN2D (0.40) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210202843-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE NANJING TOPTO SEMICONDUCTOR MATERIAL CO., LTD. (CN) 2021-07-01 — — 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 (1 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-20210202843-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE L1CAM, C1S, H1-10 MEN1 1080/4885KMT2A 3076/4885RAD52 2530/4885

“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.

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