SCHEMBL19725228

SCHEMBL19725228

O=[N+]([O-])c1ccccc1-c1cc2c3ccccc3n3c4ccccc4c(c1)c23

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ LMNA P02545 1/20 0.42
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ GUSB P08236 1/20 0.38
▸ F2 P00734 1/20 0.38
▸ C1R P00736 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ GABRA3 P34903 1/20 0.38
▸ GABRA2 P47869 1/20 0.38

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
SCHEMBL24161835 0.89 ALDH1A1 (0.46) ALDH1A1TDP1LMNAPOLBMAPT
SCHEMBL19725244 0.85 MAPK1 (0.42) ALDH1A1LMNAPOLBMAPTKMT2A
SCHEMBL19564390 0.85 ALDH1A1 (0.47) ALDH1A1TDP1LMNAMAPTKMT2A
SCHEMBL15741306 0.81 ALDH1A1 (0.44) ALDH1A1TDP1LMNAMAPTKMT2A
SCHEMBL31722551 0.80 TDP1 (0.42) ALDH1A1TDP1LMNAPOLBMAPT
SCHEMBL26528548 0.80 TDP1 (0.42) ALDH1A1TDP1LMNAPOLBMAPT
SCHEMBL11921490 0.79 ALDH1A1 (0.51) ALDH1A1TDP1LMNAMAPTKMT2A
SCHEMBL17029060 0.78 ALDH1A1 (0.46) ALDH1A1TDP1LMNAPOLBMAPT
SCHEMBL16050101 0.78 ALDH1A1 (0.43) ALDH1A1TDP1LMNAPOLBMAPT
SCHEMBL20569360 0.78 TDP1 (0.46) ALDH1A1TDP1LMNAPOLBMAPT

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-20170365795-A1 ORGANIC COMPOUND FOR OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2017-12-21 — — US disclosed
US-20170365795-A1 ORGANIC COMPOUND FOR OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 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 (1 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-20170365795-A1 ORGANIC COMPOUND FOR OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 ALDH1A1 37/4885TDP1 3214/4885LMNA 4854/4885

“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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