SCHEMBL19636322

SCHEMBL19636322

O=[N+]([O-])c1ccccc1-c1ccc2c(c1)c1ccc3ccccc3c1n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ HPRT1 P00492 1/20 0.41
▸ HTT P42858 2/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ GUSB P08236 1/20 0.36
▸ F2 P00734 1/20 0.36
▸ C1R P00736 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MPI P34949 1/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ LMNA P02545 3/20 0.34
▸ PKM P14618 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CASP6 P55212 1/20 0.33

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
SCHEMBL19382943 0.92 ALDH1A1 (0.43) ALDH1A1TDP1HPRT1HTTMEN1
SCHEMBL16862764 0.85 ALDH1A1 (0.48) ALDH1A1TDP1HTTMEN1KMT2A
SCHEMBL15845379 0.85 ALDH1A1 (0.41) ALDH1A1TDP1HTTMEN1KMT2A
SCHEMBL14756544 0.85 ALDH1A1 (0.50) ALDH1A1TDP1HTTMEN1KMT2A
SCHEMBL31591281 0.83 L3MBTL1 (0.40) ALDH1A1HPRT1HTTMEN1KMT2A
SCHEMBL28473916 0.83 L3MBTL1 (0.40) ALDH1A1HPRT1HTTMEN1KMT2A
SCHEMBL16862766 0.82 ALDH1A1 (0.48) ALDH1A1TDP1HTTMEN1KMT2A
SCHEMBL19167984 0.82 L3MBTL1 (0.47) ALDH1A1HTTMEN1KMT2AF2
SCHEMBL16932050 0.81 ALDH1A1 (0.47) ALDH1A1TDP1HPRT1HTTMEN1
SCHEMBL20390303 0.81 ALDH1A1 (0.43) ALDH1A1TDP1HPRT1HTTMEN1

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-11713291-B2 Compound for organic electronic device, organic electronic device using same, and electronic apparatus thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-08-01 — — US disclosed
WO-2017200320-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF 덕산네오룩스 주식회사 2017-11-23 — — 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 (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-11713291-B2 Compound for organic electronic device, organic electronic device using same, and electronic apparatus thereof PIEZO1, ORAI2, EXOC1 ALDH1A1 2268/4885TDP1 1783/4885HPRT1 218/4885

“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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