SCHEMBL6742319

SCHEMBL6742319

CCOC(=O)/C=C/c1ccccc1[C@@H](OC[C@H]1CO1)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.45
L3MBTL1 Q9Y468 4/20 0.38
CYP3A4 P08684 2/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 3/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ESR1 P03372 1/20 0.35
CCNC P24863 1/20 0.35
CDK8 P49336 1/20 0.35
LMNA P02545 2/20 0.35
ALOX5 P09917 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35

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
SCHEMBL6743514 1.00 MGLL (0.45) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL2480349 0.88 MGLL (0.47) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL17227031 0.87 MGLL (0.46) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL6792944 0.86 MGLL (0.46) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL6742394 0.86 MGLL (0.46) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL13265216 0.84 KDM4E (0.41) L3MBTL1CYP3A4NPC1RAB9AKDM4E
SCHEMBL12202219 0.84 MGLL (0.44) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL6742853 0.84 MGLL (0.44) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL11493175 0.78 ALDH1A1 (0.52) MGLLL3MBTL1CYP3A4NPC1RAB9A
SCHEMBL6742922 0.77 MGLL (0.43) MGLLL3MBTL1CYP3A4KDM4ECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183272-B2 Indanyl compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-22 US disclosed
US-8183272-B2 Indanyl compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-22 US disclosed
US-8173631-B2 Cyclic amine compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-8173631-B2 Cyclic amine compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-20110319468-A1 CYCLIC AMINE COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 US disclosed
US-20110319468-A1 CYCLIC AMINE COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 US disclosed
US-20110319359-A1 INDANYL COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 US disclosed
US-20110319359-A1 INDANYL COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 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 (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-20110319468-A1 CYCLIC AMINE COMPOUNDS RYR2, CASR, RYR1 MGLL 2051/4885L3MBTL1 4719/4885CYP3A4 792/4885
US-20110319359-A1 INDANYL COMPOUNDS RYR2, ORAI1, CASR MGLL 2501/4885L3MBTL1 4401/4885CYP3A4 373/4885

“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.