SCHEMBL20997996

SCHEMBL20997996

O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2ccccc2N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.39
▸ NR1H2 P55055 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ PDE6D O43924 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
SCHEMBL20997794 0.80 HTR7 (0.43) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL20997995 0.80 NPSR1 (0.34) ALDH1A1HTT
SCHEMBL20022915 0.79 ALDH1A1 (0.36) MGLLNR1H2ALDH1A1
SCHEMBL20997787 0.78 ALDH1A1 (0.42) MGLLNR1H2ALDH1A1HSD17B10LMNA
SCHEMBL20997784 0.78 PTGS2 (0.40) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL20997988 0.77 MGLL (0.40) MGLLNR1H2
SCHEMBL19072275 0.75 FAAH (0.33) MGLLALDH1A1HTTPDE6D
SCHEMBL20997788 0.75 NPSR1 (0.35) ALDH1A1HTT
SCHEMBL23911724 0.73 CA2 (0.32) —
SCHEMBL20022918 0.73 FAAH (0.40) MGLLALDH1A1PDE6D

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-11563187-B2 Nitrogen-containing compound-containing compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-01-24 — — US disclosed
US-20190148652-A1 NITROGEN-CONTAINING COMPOUND-CONTAINING COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-05-16 — — 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-20190148652-A1 NITROGEN-CONTAINING COMPOUND-CONTAINING COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME L1CAM, C1S, CHRM1 MGLL 3342/4885NR1H2 2387/4885ALDH1A1 1501/4885
US-11563187-B2 Nitrogen-containing compound-containing compound and organic electroluminescence device including the same L1CAM, C1S, CHRM1 MGLL 3342/4885NR1H2 2387/4885ALDH1A1 1501/4885

“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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