SCHEMBL21740425

SCHEMBL21740425

C=N/C(=N\C(Cl)=N/Cc1ccccc1)c1cccc(-c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 8/20 0.41
▸ GRIN1 Q05586 4/20 0.41
▸ GRIN2D O15399 2/20 0.41
▸ GRIN3B O60391 2/20 0.41
▸ GRIN2A Q12879 2/20 0.41
▸ GRIN2C Q14957 2/20 0.41
▸ GRIN3A Q8TCU5 2/20 0.41
▸ KMO O15229 1/20 0.36
▸ GPR52 Q9Y2T5 1/20 0.36
▸ PRSS1 P07477 1/20 0.36
▸ PRSS2 P07478 1/20 0.36
▸ PRSS3 P35030 1/20 0.36
▸ ERCC5 P28715 1/20 0.35
▸ FEN1 P39748 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.34
▸ MGLL Q99685 1/20 0.34

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
SCHEMBL25944765 0.86 GRIN2B (0.45) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL24054155 0.81 GRIN2B (0.54) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL20617241 0.80 GRIN2B (0.44) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL23312689 0.78 GRIN2B (0.36) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL21669143 0.78 KMO (0.40) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL23676819 0.77 GRIN2B (0.37) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL22115000 0.74 PDK2 (0.36) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL21740675 0.73 MRGPRX4 (0.36) GRIN2BGRIN1GPR52
SCHEMBL22343406 0.73 GRIN2B (0.38) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL26520226 0.73 TDP2 (0.37) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A

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
EP-3470398-B1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER NOVALED GMBH (DE) 2022-05-04 — — EP disclosed
US-20200317704-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer NOVALED GMBH (DE) 2020-10-08 — — US disclosed
EP-3611173-A1 ORGANIC LIGHT EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER IN ORGANIC LIGHT EMITTING ELEMENT Heesung Material Ltd. (KR) 2020-02-19 — — EP disclosed
WO-2019072932-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER NOVALED GMBH (DE) 2019-04-18 — — WO 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-20200317704-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer SELE, EPCAM, OR51E2 GRIN2B 1149/4885GRIN1 2406/4885GRIN2D 694/4885

“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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