SCHEMBL4886217

SCHEMBL4886217

O=C(O)CCCCCNc1ccc2ccc3c(S(=O)(=O)O)ccc4ccc1c2c43

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.41
CDC25B P30305 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TBXA2R P21731 1/20 0.41
FABP4 P15090 4/20 0.40
NR4A2 P43354 1/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
GFER P55789 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 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
SCHEMBL17119894 0.85 KMT2A (0.57) CDC25ACDC25BMEN1KMT2APOLB
SCHEMBL1673086 0.82 CDC25A (0.43) CDC25ACDC25BMEN1KMT2APOLB
SCHEMBL592088 0.76 KMT2A (0.61) MEN1KMT2APOLBTDP1ALDH1A1
SCHEMBL10001904 0.73 AURKA (0.47) MEN1KMT2ATDP1ALDH1A1FABP4
SCHEMBL4923891 0.73 CYP1A2 (0.67) MEN1KMT2APOLBALDH1A1FABP4
SCHEMBL11528264 0.72 AURKA (0.46) MEN1KMT2ATDP1ALDH1A1FABP4
SCHEMBL22083438 0.70 ALDH1A1 (0.65) CDC25ACDC25BMEN1KMT2ATDP1
SCHEMBL17803468 0.68 HDAC3 (0.36) ALDH1A1HSD17B10KDM4EHDAC3HDAC4
SCHEMBL20910938 0.68 ALDH1A1 (0.67) MEN1KMT2ATDP1ALDH1A1HSD17B10
SCHEMBL3822788 0.67 AURKA (0.42) MEN1KMT2ATDP1ALDH1A1HSD17B10

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-20150268246-A1 LUMINESCENT COMPOUNDS SETA BIOMEDICALS, LLC 2015-09-24 US disclosed
US-20080076188-A1 Luminescent compounds SETA BIOMEDICALS, LLC 2008-03-27 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-20080076188-A1 Luminescent compounds REL, QRFPR, RCOR3 CDC25A 2415/4885CDC25B 2153/4885MEN1 3074/4885

“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.