SCHEMBL17847448

SCHEMBL17847448

CCSc1ccc(N=C=O)c(Sc2ccccc2)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 3/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRB2 P47870 1/20 0.32
▸ PDE7A Q13946 1/20 0.31
▸ PDE7B Q9NP56 1/20 0.31
▸ CA2 P00918 1/20 0.30
▸ CA4 P22748 1/20 0.30
▸ TRPA1 O75762 1/20 0.30
▸ EPHX2 P34913 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 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
SCHEMBL19712975 0.84 SLC6A4 (0.38) CYP3A4PTGS2MAOAMAOBALDH1A1
SCHEMBL10985009 0.83 CYP3A4 (0.37) CYP3A4ALDH1A1HPGDTDP1GABRA1
SCHEMBL17847474 0.82 GABRA1 (0.36) CYP3A4PTGS2ALDH1A1HPGDTDP1
SCHEMBL19712969 0.80 PDE7A (0.47) PDE7APDE7BSLC6A2SLC6A4SLC6A3
SCHEMBL17847501 0.80 CYP3A4 (0.41) CYP3A4ALDH1A1HPGDTDP1TRPA1
SCHEMBL19712993 0.80 HTR2C (0.34) CYP3A4ALDH1A1HPGDTDP1GABRA1
SCHEMBL19712988 0.79 SQOR (0.37) CYP3A4PTGS2MAOAMAOBALDH1A1
SCHEMBL19712976 0.77 CYP3A4 (0.35) CYP3A4ALDH1A1HPGD
SCHEMBL19712961 0.77 ALDH1A1 (0.38) CYP3A4ALDH1A1HPGDTDP1PDE7A
SCHEMBL17847493 0.76 BCL2 (0.39) CYP3A4GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233791-B1 MOISTURE STABLE HOLOGRAPHIC MEDIA COVESTRO DEUTSCHLAND AG (DE) 2020-08-12 — — EP disclosed
US-10329244-B2 Moisture-stable holographic media COVESTRO DEUTSCHLAND AG (DE) 2019-06-25 — — US disclosed
US-20170362165-A1 MOISTURE-STABLE HOLOGRAPHIC MEDIA COVESTRO DEUTSCHLAND AG (DE) 2017-12-21 — — US disclosed
EP-3233791-A1 MOISTURE-STABLE HOLOGRAPHIC MEDIA Covestro Deutschland AG (DE) 2017-10-25 — — EP disclosed
CN-107223121-A Wet stable holographic media 科思创德国股份有限公司 2017-09-29 — — CN disclosed
WO-2016096641-A1 MOISTURE-STABLE HOLOGRAPHIC MEDIA COVESTRO DEUTSCHLAND AG (DE) 2016-06-23 — — 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 (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-10329244-B2 Moisture-stable holographic media NEFM, MDM4, BHMT2 CYP3A4 3992/4885PTGS2 77/4885MAOA 494/4885
US-20170362165-A1 MOISTURE-STABLE HOLOGRAPHIC MEDIA NEFM, MDM4, BHMT2 CYP3A4 3992/4885PTGS2 77/4885MAOA 494/4885

“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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