SCHEMBL20997787

SCHEMBL20997787

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MGLL Q99685 1/20 0.39
▸ SRD5A2 P31213 2/20 0.38
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ ATM Q13315 3/20 0.36
▸ CDC25B P30305 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ CCR6 P51684 1/20 0.35

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
SCHEMBL20998012 0.88 ATM (0.41) ALDH1A1MEN1KMT2AMGLLATM
SCHEMBL20998011 0.84 ALDH1A1 (0.44) ALDH1A1MAPTGAAATMCDC25B
SCHEMBL20383394 0.83 ALDH1A1 (0.44) ALDH1A1RAB9ALMNAMAPTMEN1
SCHEMBL20997831 0.81 PGR (0.37) ALDH1A1RAB9ALMNAMAPTMEN1
SCHEMBL19829081 0.81 ALDH1A1 (0.41) ALDH1A1RAB9ALMNAMAPTMEN1
SCHEMBL20998009 0.80 ATM (0.56) ALDH1A1MAPTGAAATMCDC25B
SCHEMBL20997794 0.80 HTR7 (0.43) ALDH1A1MGLLNPSR1NR1H2HSD17B10
SCHEMBL20997996 0.78 MGLL (0.39) ALDH1A1LMNAMGLLNR1H2HSD17B10
SCHEMBL20997784 0.78 PTGS2 (0.40) ALDH1A1LMNAMGLLGAAPKM
SCHEMBL20997988 0.77 MGLL (0.40) MGLLNR1H2TSHR

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 ALDH1A1 1501/4885RAB9A 2601/4885LMNA 1851/4885
US-11563187-B2 Nitrogen-containing compound-containing compound and organic electroluminescence device including the same L1CAM, C1S, CHRM1 ALDH1A1 1501/4885RAB9A 2601/4885LMNA 1851/4885

“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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