SCHEMBL15070913

SCHEMBL15070913

C=CCCCC(CC)(CC=C)C(=O)OCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.54
CYP4A11 Q02928 2/20 0.54
PKM P14618 2/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.35
ALDH1A1 P00352 4/20 0.34
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 4/20 0.33
ATM Q13315 1/20 0.33
TSHR P16473 1/20 0.32
USP2 O75604 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL15070911 0.92 CYP4F2 (0.47) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL27681347 0.90 CYP4F2 (0.54) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL16150101 0.86 CYP4F2 (0.50) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL10023943 0.86 CYP4F2 (0.50) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL23132525 0.85 CYP4F2 (0.42) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL1361264 0.82 CYP4F2 (0.44) CYP4F2CYP4A11PKMTHRBHTT
Propylene Glycol SCHEMBL27727755 0.82 CYP4F2 (0.49) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL21703602 0.81 CYP4F2 (0.63) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL15074624 0.80 MEN1 (0.42) CYP4F2CYP4A11PKMTHRBHTT
SCHEMBL3772643 0.80 CYP4F2 (0.43) CYP4F2CYP4A11PKMTHRBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180065914-A1 RUTHENIUM POLYMERISATION CATALYSTS UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2018-03-08 US disclosed
US-9815765-B2 Ruthenium polymerisation catalysts UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) 2017-11-14 US disclosed
US-9233994-B2 Ruthenium complexes for use in olefin metathesis UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) 2016-01-12 US disclosed
US-20140228563-A1 RUTHENIUM POLYMERISATION CATALYSTS UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) 2014-08-14 US disclosed
US-20130165649-A1 RUTHENIUM COMPLEXES FOR USE IN OLEFIN METATHESIS UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) 2013-06-27 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 (3 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-20180065914-A1 RUTHENIUM POLYMERISATION CATALYSTS RRP12, PCBP1, PARG CYP4F2 1707/4885CYP4A11 3716/4885PKM 273/4885
US-20130165649-A1 RUTHENIUM COMPLEXES FOR USE IN OLEFIN METATHESIS OSBP, CYCS, OSBPL3 CYP4F2 341/4885CYP4A11 2489/4885PKM 3045/4885
US-20140228563-A1 RUTHENIUM POLYMERISATION CATALYSTS RRP12, PCBP1, PARG CYP4F2 1707/4885CYP4A11 3716/4885PKM 273/4885

“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.