SCHEMBL8076218

SCHEMBL8076218

COC(=O)C1CCc2cc(OC)ccc2C1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.59
CA2 P00918 4/20 0.59
ACHE P22303 4/20 0.59
MTNR1A P48039 2/20 0.56
MTNR1B P49286 1/20 0.56
FAAH O00519 6/20 0.51
DRD2 P14416 3/20 0.50
DRD3 P35462 3/20 0.50
CYP26A1 O43174 1/20 0.50
PKM P14618 1/20 0.49
CYP19A1 P11511 1/20 0.47

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
SCHEMBL8603697 1.00 CA1 (0.59) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL8066286 1.00 CA1 (0.59) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL545767 0.94 MTNR1A (0.63) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL8606735 0.94 MTNR1A (0.63) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL8074296 0.94 MTNR1A (0.63) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL345640 0.88 NPC1 (0.49) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL388601 0.88 MTNR1A (0.54) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL7280750 0.87 FAAH (0.48) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL970670 0.87 CA1 (0.56) CA1CA2ACHEMTNR1AMTNR1B
SCHEMBL8603749 0.87 CA1 (0.56) CA1CA2ACHEMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2697207-B1 3-(2-ARYL-CYCLOALKENYLMETHYL)-OXAZOLIDIN-2-ONE DERIVATIVES AS CHOLESTEROL ESTER TRANSFER PROTEIN (CETP) INHIBITORS CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2016-12-14 EP disclosed
US-9504675-B2 Alpha-ketoheterocycles and methods of making and using THE SCRIPPS RESEARCH INSTITUTE (US) 2016-11-29 US disclosed
US-9504675-B2 Alpha-ketoheterocycles and methods of making and using THE SCRIPPS RESEARCH INSTITUTE (US) 2016-11-29 US disclosed
US-9371294-B2 Cycloalkenyl aryl derivatives for CETP inhibitor CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2016-06-21 US disclosed
EP-2670245-B1 ALPHA-KETOHETEROCYCLES AND METHODS OF MAKING AND USING SCRIPPS RESEARCH INST (US) 2015-09-09 EP disclosed
US-20150119376-A2 CYCLOALKENYL ARYL DERIVATIVES FOR CETP INHIBITOR CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2015-04-30 US disclosed
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
EP-2697207-A2 CYCLOALKENYL ARYL DERIVATIVES FOR CETP INHIBITOR Chong Kun Dang Pharmaceutical Corp. (KR) 2014-02-19 EP disclosed
US-20140031335-A1 CYCLOALKENYL ARYL DERIVATIVES FOR CETP INHIBITOR CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2014-01-30 US disclosed
WO-2012141487-A2 CYCLOALKENYL ARYL DERIVATIVES FOR CETP INHIBITOR CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2012-10-18 WO disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
EP-0683236-B1 Enzymatic process for the preparation of optical active tetralin-derivatives SANOFI SYNTHELABO (FR) 2000-08-09 EP disclosed
US-5719308-A Enzymatic process for the preparation of optically active tetralin derivatives SANOFI (FR) 1998-02-17 US disclosed
US-5573949-A Enzymatic process for the preparation of optically active Tetrahydro-2-naphthoic acids SANOFI (FR) 1996-11-12 US disclosed
EP-0683236-A1 Enzymatic process for the preparation of optical active tetralin-derivatives SANOFI (FR) 1995-11-22 EP disclosed
EP-0678579-A1 Enzymatic process for the preparation of optical active tetralin-derivatives MIDY S.p.A. (IT) 1995-10-25 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 (4 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-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 CA1 400/4885CA2 413/4885ACHE 3602/4885
US-20150119376-A2 CYCLOALKENYL ARYL DERIVATIVES FOR CETP INHIBITOR CETP, MTTP, LCAT CA1 4543/4885CA2 3634/4885ACHE 1233/4885
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, H1-3, H1-5 CA1 844/4885CA2 826/4885ACHE 1149/4885
US-20140031335-A1 CYCLOALKENYL ARYL DERIVATIVES FOR CETP INHIBITOR CETP, MTTP, LCAT CA1 4543/4885CA2 3634/4885ACHE 1233/4885

“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.