SCHEMBL7597791

SCHEMBL7597791

CS(=O)(=O)OCCCCCCCCCCCCCCCCCCc1ccc(I)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MMP9 P14780 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
CA2 P00918 3/20 0.37
MGLL Q99685 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
MITF O75030 1/20 0.34

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
SCHEMBL4969784 0.98 KDM4E (0.52) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL4970012 0.93 KDM4E (0.48) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL3863603 0.86 CA1 (0.43) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL6041286 0.83 KDM4E (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL26316551 0.83 ALDH1A1 (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL23014971 0.83 KDM4E (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL8435356 0.83 KDM4E (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL9701570 0.82 TDP1 (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL8661648 0.81 LMNA (0.44) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL11279959 0.81 TSHR (0.52) KDM4EUSP2ALDH1A1LMNAMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6417384-B1 SUPERIOR IMAGING AND VISUALIZATION OF NEOPLASTIC LESIONS; TUMOR-SPECIFIC CYTOTOXIC CANCER THERAPY, DIAGNOSIS AND TREATMENT THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-07-09 US disclosed
US-20020065429-A1 Radioiodinated phospholipid ether analogs and methods of using the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-05-30 US disclosed
US-6255519-B1 RADIOLABELLED PHARMACEUTICALS AND BIOLOGICAL PROBES UEFUL IN CANCER DIAGNOSIS AND TREATMENT; IMAGING TECHNOLOGY REGENTS OF THE UNIVERSITY OF MICHIGAN 2001-07-03 US disclosed
WO-1998024480-A1 RADIOIODINATED PHOSPHOLIPID ETHER ANALOGS AND METHODS OF USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1998-06-11 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-20020065429-A1 Radioiodinated phospholipid ether analogs and methods of using the same PHOSPHO1, CDIPT, LPCAT3 KDM4E 1716/4885USP2 3785/4885ALDH1A1 3832/4885

“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.