SCHEMBL459671

SCHEMBL459671

C/C=C(/C)C(=O)OC1C=Cc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 1/20 0.31
RET P07949 2/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BRD4 O60885 1/20 0.30
CCL2 P13500 1/20 0.30
HPGD P15428 1/20 0.30
RCE1 Q9Y256 1/20 0.30

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
SCHEMBL17222502 1.00 POLB (0.37) POLBALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL15664847 0.84 POLB (0.37) POLBALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL8694188 0.83 POLB (0.49) POLBALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL89374 0.83 POLB (0.49) POLBALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL8697270 0.83 POLB (0.49) POLBALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL28304038 0.82 POLB (0.47) POLBALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL27902025 0.80 POLB (0.34) POLBALDH1A1SMN1; SMN2KDM4ERET
SCHEMBL6700611 0.80 POLB (0.39) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL50555 0.79 POLB (0.37) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL29059172 0.79 POLB (0.37) POLBALDH1A1SMN1; SMN2KDM4EMAPT

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 167 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180289654-A1 Therapeutic Compositions PEPLIN RESEARCH PTY LIMITED (AU) 2018-10-11 US claimed
US-9895334-B2 Treatment of virally induced lesions LEO LABORATORIES LIMITED (IE) 2018-02-20 US claimed
US-9861603-B2 Therapeutic compositions LEO LABORATORIES LIMITED (IE) 2018-01-09 US claimed
US-9833428-B2 Therapeutic compositions LEO LABORATORIES LIMITED (IE) 2017-12-05 US claimed
US-9833429-B2 Therapeutic compositions LEO LABORATORIES LIMITED (IE) 2017-12-05 US claimed
US-9820959-B2 Therapeutic compositions LEO LABORATORIES LIMITED (IE) 2017-11-21 US claimed
US-20140357712-A1 THERAPEUTIC COMPOSITIONS LEO LABORATORIES LIMITED (IE) 2014-12-04 US claimed
US-20140249218-A1 ADMINISTRATION OF INGENOL MEBUTATE LEO LABORATORIES LIMITED (IE) 2014-09-04 US claimed
US-8735375-B2 Therapeutic compositions LEO LABORATORIES LIMITED (IE) 2014-05-27 US claimed
US-8716271-B2 Therapeutic compositions LEO LABORATORIES LIMITED (IE) 2014-05-06 US claimed
US-20120309827-A1 THERAPEUTIC COMPOSITIONS LEO LABORATORIES LIMITED (IE) 2012-12-06 US claimed
US-20120295970-A1 THERAPEUTIC COMPOSITIONS LEO LABORATORIES LIMITED (IE) 2012-11-22 US claimed
US-20120295971-A1 THERAPEUTIC COMPOSITIONS LEO LABORATORIES LIMITED (IE) 2012-11-22 US claimed
EP-2399571-A1 Therapeutic compositions comprising ingenol-3-angelate Peplin Research Pty Ltd. (AU) 2011-12-28 EP claimed
US-20090292017-A1 THERAPEUTIC COMPOSITIONS PEPLIN RESEARCH PTY LIMITED 2009-11-26 US claimed
EP-1988877-A2 THERAPEUTIC COMPOSITIONS COMPRISING INGENOL-3-ANGELATE Peplin Research Pty Ltd. (AU) 2008-11-12 EP claimed
EP-1951221-A1 USE OF ANGELOYL-SUBSTITUTED INGENANES IN COMBINATION WITH OTHER AGENTS TO TREAT CANCER Peplin Research Pty Ltd. (AU) 2008-08-06 EP claimed
US-20080069809-A1 Compositions and methods for the diagnosis and treatment of cancer PEPLIN RESEARCH PTY LTD (AU) 2008-03-20 US claimed
WO-2007068963-A2 THERAPEUTIC COMPOSITIONS COMPRISING INGENOL-3-ANGELATE PEPLIN RESEARCH PTY LTD (AU) 2007-06-21 WO claimed
WO-2007053912-A1 USE OF ANGELOYL-SUBSTITUTED INGENANES IN COMBINATION WITH OTHER AGENTS TO TREAT CANCER PEPLIN RESEARCH PTY LTD (AU) 2007-05-18 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 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-20090292017-A1 THERAPEUTIC COMPOSITIONS TP53, ERGIC1, MCL1 POLB 4024/4885ALDH1A1 1407/4885SMN1; SMN2 2616/4885
US-20120295971-A1 THERAPEUTIC COMPOSITIONS TP53, ERGIC1, MCL1 POLB 4024/4885ALDH1A1 1407/4885SMN1; SMN2 2616/4885
US-20120309827-A1 THERAPEUTIC COMPOSITIONS TP53, ERGIC1, MCL1 POLB 4024/4885ALDH1A1 1407/4885SMN1; SMN2 2616/4885
US-20080069809-A1 Compositions and methods for the diagnosis and treatment of cancer TP53, MKI67, ANXA5 POLB 448/4885ALDH1A1 808/4885SMN1; SMN2 2478/4885
US-20140249218-A1 ADMINISTRATION OF INGENOL MEBUTATE PDE8B, PRKAR2B, PRKCB POLB 1561/4885ALDH1A1 3196/4885SMN1; SMN2 4628/4885
US-20180289654-A1 Therapeutic Compositions TP53, ERGIC1, MCL1 POLB 4024/4885ALDH1A1 1407/4885SMN1; SMN2 2616/4885
US-20120295970-A1 THERAPEUTIC COMPOSITIONS TP53, ERGIC1, MCL1 POLB 4024/4885ALDH1A1 1407/4885SMN1; SMN2 2616/4885
US-20140357712-A1 THERAPEUTIC COMPOSITIONS TP53, ERGIC1, MCL1 POLB 4024/4885ALDH1A1 1407/4885SMN1; SMN2 2616/4885

“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.