SCHEMBL5848282

SCHEMBL5848282

O=c1ccc2ccc3c(c2o1)CCO3

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.50
▸ ALDH1A1 P00352 6/20 0.50
▸ HPGD P15428 6/20 0.50
▸ MAPT P10636 3/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ HSD17B10 Q99714 3/20 0.47
▸ GAA P10253 3/20 0.47
▸ CYP2A6 P11509 2/20 0.42
▸ LMNA P02545 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ MCL1 Q07820 2/20 0.42
▸ PRKD3 O94806 1/20 0.42
▸ EGFR P00533 1/20 0.42
▸ PRKCG P05129 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ PRKCB P05771 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ ALOX15 P16050 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
SCHEMBL27003471 0.76 KDM4E (0.44) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL31573923 0.74 MAOA (0.40) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL4931181 0.72 CYP1A2 (0.55) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL29590196 0.72 KDM4E (0.62) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL6778388 0.69 CYP1A2 (0.50) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL27678258 0.69 KDM4E (0.55) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL27678257 0.67 KDM4E (0.52) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL3277376 0.66 GAA (0.49) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL29207958 0.66 CYP1A2 (0.58) KDM4EALDH1A1HPGDMAPTCYP3A4
SCHEMBL19776415 0.66 ALDH1A1 (0.40) ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7150967-B2 Fluorescent tags for amino acid and nucleic acid analysis UNIVERSITY OF MEDICINE & DENTISTRY OF NEW JERSEY (US) 2006-12-19 — — US disclosed
US-20040018517-A1 Fluorescent tags for amino acid and nucleic acid analysis RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-01-29 — — US disclosed
EP-0810861-B1 SUKSDORFIN ANALOGS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING AND USING THEREOF UNIV NORTH CAROLINA (US) 2002-06-05 — — EP disclosed
US-6319929-B1 VIRAL DISEASES AND HIV TREATMENT THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2001-11-20 — — US disclosed
US-5847165-A Suksdorfin analogs, compositions thereof, and methods for making and using thereof THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1998-12-08 — — US disclosed
EP-0810861-A4 SUKSDORFIN ANALOGS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING AND USING THEREOF UNIV NORTH CAROLINA (US) 1998-07-08 — — EP disclosed
US-5726204-A RETROVIRUS INHIBITORS BIOTECH RESEARCH LABORATORIES (US) 1998-03-10 — — US disclosed
EP-0810861-A1 SUKSDORFIN ANALOGS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING AND USING THEREOF The University of North Carolina at Chapel Hill (US) 1997-12-10 — — EP disclosed
US-5637589-A VIRICIDES; THERAPY FOR RETROVIRUS OR AIDS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1997-06-10 — — US disclosed
WO-1996025930-A1 SUKSDORFIN ANALOGS, COMPOSITIONS THEREOF, AND METHODS FOR MAKING AND USING THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1996-08-29 — — WO disclosed
WO-1995029920-A1 KHELLACTONE DERIVATIVES AND RELATED COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIVIRAL AND IMMUNOSTIMULATING AGENTS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1995-11-09 — — 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-20040018517-A1 Fluorescent tags for amino acid and nucleic acid analysis DNTT, DIMT1, NUDT1 KDM4E 4562/4885ALDH1A1 488/4885HPGD 543/4885

“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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