SCHEMBL22963698

SCHEMBL22963698

c1ccc(-c2ccc(-c3nc4ccccc4nc3-c3cccc(-c4cc5cccnc5c5ccccc45)c3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.44
▸ TOP1 P11387 6/20 0.43
▸ L3MBTL1 Q9Y468 5/20 0.41
▸ LMNA P02545 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ CYP11B1 P15538 1/20 0.40
▸ CCR1 P32246 2/20 0.39
▸ CCR8 P51685 2/20 0.39
▸ PDE4A P27815 1/20 0.39
▸ PDE4C Q08493 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ PIK3CD O00329 1/20 0.39
▸ NPSR1 Q6W5P4 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
SCHEMBL22963528 0.99 ALDH1A1 (0.43) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963186 0.97 ALDH1A1 (0.44) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963279 0.97 ALDH1A1 (0.44) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963346 0.97 ALDH1A1 (0.47) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963302 0.96 TOP1 (0.45) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963204 0.96 TOP1 (0.45) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963543 0.96 ALDH1A1 (0.46) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963657 0.94 TOP1 (0.43) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963488 0.93 TOP1 (0.49) ALDH1A1TOP1L3MBTL1LMNAKDM4E
SCHEMBL22963567 0.93 TOP1 (0.49) ALDH1A1TOP1L3MBTL1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210043843-A1 COMPOUND, ORGANIC LIGHT EMITTING DEVICE, AND DISPLAY DEVICE SK MATERIALS CO., LTD. (KR) 2021-02-11 — — 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-20210043843-A1 COMPOUND, ORGANIC LIGHT EMITTING DEVICE, AND DISPLAY DEVICE ALDH1A2, L1CAM, OCIAD1 ALDH1A1 28/4885TOP1 3671/4885L3MBTL1 282/4885

“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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