SCHEMBL17847481

SCHEMBL17847481

O=C=Nc1ccc(I)cc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
TRPA1 O75762 1/20 0.33
BACE1 P56817 1/20 0.32
MAPK1 P28482 1/20 0.31
PARP1 P09874 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
SCHEMBL278674 0.84 CYP3A4 (0.53) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL2807367 0.81 CYP3A4 (0.49) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL17847479 0.79 CYP3A4 (0.44) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL11613362 0.79 PTGDR2 (0.42) CYP3A4TDP1ALDH1A1HPGDMAPK1
SCHEMBL15822503 0.79 PTGDR2 (0.42) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL17847449 0.79 CYP3A4 (0.38) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL29687996 0.77 CYP3A4 (0.48) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL185120 0.77 CYP3A4 (0.48) CYP3A4TDP1ALDH1A1HPGDCASP3
SCHEMBL11385650 0.77 BACE1 (0.35) ALDH1A1HPGDBACE1MAPK1PARP1
Methane SCHEMBL27501832 0.76 CYP3A4 (0.47) CYP3A4TDP1ALDH1A1HPGDCASP3

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
CN-107223121-B Wet stable holographic media 科思创德国股份有限公司 2020-10-27 CN disclosed
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
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 3992/4885TDP1 1478/4885ALDH1A1 3155/4885
US-20170362165-A1 MOISTURE-STABLE HOLOGRAPHIC MEDIA NEFM, MDM4, BHMT2 CYP3A4 3992/4885TDP1 1478/4885ALDH1A1 3155/4885

“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.