SCHEMBL6662678

SCHEMBL6662678

COc1ccc(C2COC(=O)C2)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.55
ALOX12 P18054 3/20 0.55
ALDH1A1 P00352 8/20 0.49
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 5/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.46
CYP19A1 P11511 2/20 0.46
HPGD P15428 1/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MAOB P27338 2/20 0.42
CYP3A4 P08684 1/20 0.42
POLB P06746 1/20 0.42
RECQL P46063 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
SCHEMBL2467272 0.86 ALOX15 (0.48) ALOX15ALOX12ALDH1A1KMT2AMEN1
SCHEMBL2474471 0.82 ALDH1A1 (0.55) ALDH1A1KMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL5234050 0.81 HTR2C (0.51) MAPTKDM4ELMNACYP19A1NPC1
SCHEMBL5239565 0.77 ALDH1A1 (0.46) ALOX12ALDH1A1KMT2AMEN1MAPK1
SCHEMBL5233147 0.77 MAP1LC3B (0.42) ALDH1A1CYP19A1MAOB
SCHEMBL29152238 0.76 GAA (0.50) KMT2AMEN1MAPK1SMN1; SMN2MAPT
SCHEMBL13923613 0.76 GAA (0.50) KMT2AMEN1MAPK1SMN1; SMN2MAPT
SCHEMBL3718533 0.76 GAA (0.50) KMT2AMEN1MAPK1SMN1; SMN2MAPT
SCHEMBL428339 0.76 ALDH1A1 (0.60) ALDH1A1KMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL19418881 0.74 ALOX15 (0.72) ALOX15ALOX12ALDH1A1CYP19A1MAOB

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
US-20040225135-A1 Method of producing optically active lactone compound KYUSHA UNIVERSITY (JP) 2004-11-11 US claimed
US-6784302-B2 HIGHER ENANTIOMERIC EXCESS BY USING A SPECIFIED ZIRCONIUM (SALEN) COMPLEX AS CATALYST TO CONDUCT A BAEYER-VILLIGER REACTION OF A CYCLIC KETONE; OXIDATION USING A HYDROGEN PEROXIDE OXIDIZER TO PRODUCE CYCLIC ESTERS KYUSHU UNIVERSITY (JP) 2004-08-31 US claimed
EP-1449840-A1 Method of producing optically active lactone compound Kyushu University (JP) 2004-08-25 EP claimed
US-6713435-B2 SUCH AS B-PHENYL-GAMMA-BUTYLOLACTONE VIA OXIDATION OF CYCLIC KETONE (3-PHENYLCYCLOBUTANONE) WITH HYDROGEN PEROXIDE/UREA HYDROGEN PEROXIDE IN PRESENCE OF COBALT/SALEN COMPLEX AS CATALYST KYUSHU UNIVERSITY (JP) 2004-03-30 US claimed
US-20040010152-A1 Method of producing optically active lactone compound and complex used in the method KYUSHU UNIVERSITY (JP) 2004-01-15 US claimed
EP-1352908-A1 Method of producing optically active lactone compound and complex used in the method KYUSHU UNIVERSITY (JP) 2003-10-15 EP claimed
US-20030120091-A1 Method for producing optically active lactone compounds by using salen cobalt complexes having a cis-beta structure KYUSHU UNIVERSITY (JP) 2003-06-26 US claimed
EP-1288210-A2 A method for producing optically active lactone compounds by using salen cobalt complexes having a CIS-Beta structure KYUSHU UNIVERSITY (JP) 2003-03-05 EP claimed
US-20040225135-A1 Method of producing optically active lactone compound KYUSHA UNIVERSITY (JP) 2004-11-11 US disclosed
US-6784302-B2 HIGHER ENANTIOMERIC EXCESS BY USING A SPECIFIED ZIRCONIUM (SALEN) COMPLEX AS CATALYST TO CONDUCT A BAEYER-VILLIGER REACTION OF A CYCLIC KETONE; OXIDATION USING A HYDROGEN PEROXIDE OXIDIZER TO PRODUCE CYCLIC ESTERS KYUSHU UNIVERSITY (JP) 2004-08-31 US disclosed
EP-1449840-A1 Method of producing optically active lactone compound Kyushu University (JP) 2004-08-25 EP disclosed
US-6713435-B2 SUCH AS B-PHENYL-GAMMA-BUTYLOLACTONE VIA OXIDATION OF CYCLIC KETONE (3-PHENYLCYCLOBUTANONE) WITH HYDROGEN PEROXIDE/UREA HYDROGEN PEROXIDE IN PRESENCE OF COBALT/SALEN COMPLEX AS CATALYST KYUSHU UNIVERSITY (JP) 2004-03-30 US disclosed
US-20040010152-A1 Method of producing optically active lactone compound and complex used in the method KYUSHU UNIVERSITY (JP) 2004-01-15 US disclosed
EP-1352908-A1 Method of producing optically active lactone compound and complex used in the method KYUSHU UNIVERSITY (JP) 2003-10-15 EP disclosed
US-20030120091-A1 Method for producing optically active lactone compounds by using salen cobalt complexes having a cis-beta structure KYUSHU UNIVERSITY (JP) 2003-06-26 US disclosed
EP-1288210-A2 A method for producing optically active lactone compounds by using salen cobalt complexes having a CIS-Beta structure KYUSHU UNIVERSITY (JP) 2003-03-05 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 (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-20040010152-A1 Method of producing optically active lactone compound and complex used in the method CYC1, CYP11B1, CYP17A1 ALOX15 142/4885ALOX12 92/4885ALDH1A1 338/4885
US-20040225135-A1 Method of producing optically active lactone compound PPOX, CYP11B1, CYP17A1 ALOX15 54/4885ALOX12 29/4885ALDH1A1 1491/4885
US-20030120091-A1 Method for producing optically active lactone compounds by using salen cobalt complexes having a cis-beta structure SOD1, OAT, SOD3 ALOX15 933/4885ALOX12 491/4885ALDH1A1 691/4885

“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.