SCHEMBL22651728

SCHEMBL22651728

CCCCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1O)c64)C(=O)N(c1ccc(S)cc1)C5=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.36
▸ POLB P06746 5/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ APAF1 O14727 1/20 0.35
▸ ALDH1A1 P00352 5/20 0.34
▸ TDP1 Q9NUW8 3/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ STAT3 P40763 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ GBA1 P04062 1/20 0.33
▸ RECQL P46063 2/20 0.32
▸ CASP6 P55212 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ TERT O14746 2/20 0.32

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
SCHEMBL22651653 0.87 STAT3 (0.37) KDM4EPOLBALOX15APAF1ALDH1A1
SCHEMBL20392828 0.84 STAT3 (0.48) KDM4EPOLBALOX15ALDH1A1TDP1
SCHEMBL22651727 0.83 STAT3 (0.41) KDM4EPOLBALOX15ALDH1A1TDP1
SCHEMBL22651744 0.82 KDM4E (0.37) KDM4EPOLBALOX15ALDH1A1HPGD
SCHEMBL18378993 0.82 STAT3 (0.50) KDM4EPOLBAPAF1ALDH1A1TDP1
SCHEMBL22651631 0.81 ALDH1A1 (0.41) KDM4EPOLBALOX15ALDH1A1L3MBTL1
SCHEMBL23987286 0.80 HEXA (0.44) KDM4EPOLBALOX15ALDH1A1TDP1
SCHEMBL22651696 0.78 KDM4E (0.36) KDM4EPOLBALOX15ALDH1A1STAT3
SCHEMBL22651619 0.78 ESR1 (0.46) KDM4EPOLBALOX15ALDH1A1TDP1
SCHEMBL22651617 0.78 ALDH1A1 (0.41) KDM4EPOLBALOX15ALDH1A1CASP6

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-20200354356-A1 SENSOR COMPOUNDS AND ASSOCIATED METHODS AND DEVICES UNIVERSITY OF UTAH 2020-11-12 — — 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-20200354356-A1 SENSOR COMPOUNDS AND ASSOCIATED METHODS AND DEVICES NCS1, DAXX, CNDP2 KDM4E 4154/4885POLB 3680/4885ALOX15 3729/4885

“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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