SCHEMBL8908018

SCHEMBL8908018

COC(C)(CC/C=C(\C)CCCC(C)C)OC

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.49
PTPN1 P18031 3/20 0.46
ALOX15 P16050 2/20 0.34
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
SNCA P37840 1/20 0.33
PDE3A Q14432 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
KMT2A Q03164 1/20 0.33
SQLE Q14534 3/20 0.32
PTPN2 P17706 1/20 0.32
CDC25B P30305 1/20 0.32

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
SCHEMBL8908025 1.00 KDM1A (0.49) KDM1APTPN1ALOX15PTGS1PDE4A
SCHEMBL15821739 1.00 KDM1A (0.49) KDM1APTPN1ALOX15PTGS1PDE4A
SCHEMBL15823839 0.97 KDM1A (0.54) KDM1APTPN1ALOX15KMT2ASQLE
SCHEMBL15823843 0.97 KDM1A (0.54) KDM1APTPN1ALOX15KMT2ASQLE
SCHEMBL20421286 0.97 KDM1A (0.54) KDM1APTPN1ALOX15KMT2ASQLE
SCHEMBL15822340 0.94 PTPN1 (0.56) KDM1APTPN1ALOX15PTGS1PDE4A
SCHEMBL15821746 0.94 PTPN1 (0.56) KDM1APTPN1ALOX15PTGS1PDE4A
SCHEMBL15822806 0.94 PTPN1 (0.56) KDM1APTPN1ALOX15PTGS1PDE4A
SCHEMBL20677648 0.94 PTPN1 (0.56) KDM1APTPN1ALOX15PTGS1PDE4A
SCHEMBL17260202 0.94 PTPN1 (0.56) KDM1APTPN1ALOX15PTGS1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2935177-B1 (6R,10R)-6,10,14-TRIMETYLPENTADECAN-2-ONE PREPARED FROM 6,10-DIMETYLUNDEC-5-EN-2-ONE OR 6,10-DIMETYLUNDECA-5,9-DIEN-2-ONE DSM IP ASSETS BV (NL) 2019-07-24 EP disclosed
EP-2935189-B1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINING ASYMMETRIC HYDROGENATION AND ISOMERIZATION DSM IP ASSETS BV (NL) 2019-06-12 EP disclosed
EP-2935233-B1 PROCESS OF ASYMMETRIC HYDROGENATION OF KETALS AND ACETALS DSM IP ASSETS BV (NL) 2019-01-30 EP disclosed
EP-2935188-B1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINED ASYMMETRIC HYDROGENATIONS DSM IP ASSETS BV (NL) 2018-08-01 EP disclosed
US-9573872-B2 Using mixtures of E/Z isomers to obtain quantitatively specific products by combining asymmetric hydrogenation and isomerization DSM IP ASSETS B.V. (NL) 2017-02-21 US disclosed
US-9561989-B2 Process of asymmetric hydrogenation of ketals and acetals DSM IP ASSETS B.V. (NL) 2017-02-07 US disclosed
US-9458076-B2 Using mixtures of E/Z isomers to obtain quantitatively specific products by combined asymmetric hydrogenations DSM IP ASSETS B.V. (NL) 2016-10-04 US disclosed
US-9452961-B2 (6R,10R)-6,10,14-trimetylpentadecan-2-one prepared from 6,10-dimetylundec-5-en-2-one or 6,10-dimetylundeca-5,9-dien-2-one DSM IP ASSETS B.V. (NL) 2016-09-27 US disclosed
US-20160185683-A1 PROCESS OF ASYMMETRIC HYDROGENATION OF KETALS AND ACETALS DSM IP ASSETS B.V. (NL) 2016-06-30 US disclosed
US-20160185702-A1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINING ASYMMETRIC HYDROGENATION AND ISOMERIZATION DSM IP ASSETS B.V. (NL) 2016-06-30 US disclosed
EP-2935189-A1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINING ASYMMETRIC HYDROGENATION AND ISOMERIZATION DSM IP Assets B.V. (NL) 2015-10-28 EP disclosed
EP-2935177-A1 (6R,10R)-6,10,14-TRIMETYLPENTADECAN-2-ONE PREPARED FROM 6,10-DIMETYLUNDEC-5-EN-2-ONE OR 6,10-DIMETYLUNDECA-5,9-DIEN-2-ONE DSM IP Assets B.V. (NL) 2015-10-28 EP disclosed
EP-2935188-A1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINED ASYMMETRIC HYDROGENATIONS DSM IP Assets B.V. (NL) 2015-10-28 EP disclosed
WO-2014096065-A1 (6R,10R)-6,10,14-TRIMETYLPENTADECAN-2-ONE PREPARED FROM 6,10-DIMETYLUNDEC-5-EN-2-ONE OR 6,10-DIMETYLUNDECA-5,9-DIEN-2-ONE DSM IP ASSETS B.V. (NL) 2014-06-26 WO disclosed
WO-2014096107-A1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINING ASYMMETRIC HYDROGENATION AND ISOMERIZATION DSM IP ASSETS B.V. (NL) 2014-06-26 WO disclosed
WO-2014096096-A1 PROCESS OF ASYMMETRIC HYDROGENATION OF KETALS AND ACETALS DSM IP ASSETS B.V. (NL) 2014-06-26 WO disclosed
WO-2014096106-A1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINED ASYMMETRIC HYDROGENATIONS DSM IP ASSETS B.V. (NL) 2014-06-26 WO disclosed
US-5600015-A USING RUTHENIUM COMPLEX OF OPTICALLY ACTIVE ATROPISOMERIC DIPHOSPHINE LIGAND AS HYDROGENATION CATALYST HOFFMANN-LA ROCHE INC. (US) 1997-02-04 US disclosed
EP-0565975-B1 Process for the preparation of isoprenoid derivatives HOFFMANN LA ROCHE (CH) 1996-09-04 EP disclosed
EP-0565975-A2 Process for the preparation of isoprenoid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1993-10-20 EP 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 (2 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-20160185702-A1 USING MIXTURES OF E/Z ISOMERS TO OBTAIN QUANTITATIVELY SPECIFIC PRODUCTS BY COMBINING ASYMMETRIC HYDROGENATION AND ISOMERIZATION EPHX2, ZDHHC2, GNE KDM1A 4641/4885PTPN1 4862/4885ALOX15 249/4885
US-20160185683-A1 PROCESS OF ASYMMETRIC HYDROGENATION OF KETALS AND ACETALS KAT5, AKR1D1, AKR1C2 KDM1A 1647/4885PTPN1 4881/4885ALOX15 177/4885

“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.