SCHEMBL7601255

SCHEMBL7601255

Ic1ccc(CCCCCCCCCCCCCCCCCCOCc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.68
TDP1 Q9NUW8 1/20 0.68
HRH4 Q9H3N8 2/20 0.48
HRH3 Q9Y5N1 2/20 0.48
SPHK1 Q9NYA1 2/20 0.47
APP P05067 1/20 0.47
TSHR P16473 1/20 0.45
SIGMAR1 Q99720 3/20 0.43
MAOB P27338 1/20 0.43
FFAR1 O14842 1/20 0.42
IDO1 P14902 1/20 0.42

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
SCHEMBL7601292 0.97 L3MBTL1 (0.64) L3MBTL1TDP1HRH4HRH3SPHK1
SCHEMBL3446778 0.89 TDP1 (0.75) L3MBTL1TDP1HRH4HRH3SPHK1
SCHEMBL20534698 0.89 TDP1 (0.75) L3MBTL1TDP1HRH4HRH3SPHK1
SCHEMBL2186600 0.86 APP (0.53) L3MBTL1TDP1HRH4HRH3APP
SCHEMBL1835993 0.85 TDP1 (0.69) L3MBTL1TDP1SPHK1
SCHEMBL27492044 0.84 TDP1 (0.45) L3MBTL1TDP1HRH4HRH3SPHK1
SCHEMBL8327886 0.84 TDP1 (0.45) L3MBTL1TDP1HRH4HRH3SPHK1
SCHEMBL7598315 0.84 L3MBTL1 (0.56) L3MBTL1TDP1HRH4HRH3SPHK1
SCHEMBL1164267 0.83 L3MBTL1 (0.68) L3MBTL1TDP1SPHK1TSHRSIGMAR1
SCHEMBL11995967 0.83 L3MBTL1 (0.72) L3MBTL1TDP1HRH4HRH3SPHK1

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 L3MBTL1 1500/4885TDP1 2906/4885HRH4 2051/4885

“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.