SCHEMBL19712964

SCHEMBL19712964

O=C=Nc1ccc(-c2ccccc2)c2cccc(Br)c12

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.42
CYP3A4 P08684 2/20 0.35
PARP1 P09874 1/20 0.33
CYP1B1 Q16678 1/20 0.31
HPGD P15428 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
C1R P00736 1/20 0.30
KMT2A Q03164 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
SCHEMBL17847464 0.82 CYP2A6 (0.38) ALDH1A1MAPK1CYP3A4PARP1HPGD
SCHEMBL19712974 0.82 PARP1 (0.39) ALDH1A1CYP3A4PARP1HPGDTDP1
SCHEMBL19713014 0.82 CYP3A4 (0.35) ALDH1A1CYP3A4PARP1HPGDTDP1
SCHEMBL17847515 0.82 CYP3A4 (0.42) ALDH1A1CYP3A4PARP1HPGDTDP1
SCHEMBL9517280 0.81 CYP3A4 (0.39) ALDH1A1MAPK1CYP3A4PARP1HPGD
SCHEMBL28478119 0.81 HKDC1 (0.33) CYP3A4
SCHEMBL19713010 0.80 GABRA1 (0.45) ALDH1A1CYP3A4PARP1HPGDTDP1
SCHEMBL21064778 0.80 CYP3A4 (0.40) ALDH1A1CYP3A4PARP1HPGDTDP1
SCHEMBL19713022 0.79 CYP3A4 (0.36) ALDH1A1CYP3A4PARP1HPGDTDP1
SCHEMBL22727730 0.77 ALDH1A1 (0.52) ALDH1A1MAPK1PARP1CYP1B1

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
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

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 ALDH1A1 3155/4885MAPK1 638/4885CYP3A4 3992/4885
US-20170362165-A1 MOISTURE-STABLE HOLOGRAPHIC MEDIA NEFM, MDM4, BHMT2 ALDH1A1 3155/4885MAPK1 638/4885CYP3A4 3992/4885

“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.