SCHEMBL22375929

SCHEMBL22375929

c1ccc(-c2nc(-c3ccc4oc5ccccc5c4c3)nc(-c3ccc(-c4ccc5c(c4)sc4ccccc45)c4oc5ccccc5c34)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.35
▸ ALDH1A1 P00352 6/20 0.34
▸ HPGD P15428 4/20 0.34
▸ CDC14B O60729 2/20 0.34
▸ CDC14A Q9UNH5 2/20 0.34
▸ MAPT P10636 10/20 0.33
▸ POLB P06746 3/20 0.32
▸ TSHR P16473 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ CHEK2 O96017 1/20 0.32
▸ LMNA P02545 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ USP2 O75604 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ PTPRF P10586 2/20 0.31

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
SCHEMBL22376521 0.96 MAPT (0.35) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL22375927 0.96 CDC14B (0.36) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL22376531 0.96 CDC14B (0.36) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL22377405 0.95 ALOX5 (0.36) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL22375930 0.95 ALOX5 (0.36) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL23820937 0.94 ALOX5 (0.35) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL23816642 0.94 CDC14B (0.38) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL23058535 0.93 ALOX5 (0.35) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL23820434 0.93 NPC1 (0.35) ALOX5ALDH1A1HPGDCDC14BCDC14A
SCHEMBL22375947 0.93 ALOX5 (0.38) ALOX5ALDH1A1HPGDCDC14BCDC14A

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-20200274070-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2020-08-27 — — 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-20200274070-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME ESR1, CCNA1, CCNE2 ALOX5 3623/4885ALDH1A1 444/4885HPGD 3060/4885

“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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