SCHEMBL6744910

SCHEMBL6744910

CCOC(=O)CCc1c(Cl)cccc1[C@@H](CC)OC[C@H]1CO1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
RIPK1 Q13546 2/20 0.36
MGLL Q99685 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
NLRP3 Q96P20 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL6744725 0.92 KDM4E (0.37) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL10134614 0.91 MGLL (0.38) KDM4EALDH1A1MGLLCYP4F2CYP4A11
SCHEMBL6796127 0.89 MEN1 (0.37) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL6744914 0.89 MEN1 (0.37) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL10134603 0.88 MGLL (0.36) MEN1KMT2AKDM4EALDH1A1TDP1
SCHEMBL10134612 0.87 ALDH1A1 (0.37) KDM4EALDH1A1TDP1MGLLPOLB
SCHEMBL12202109 0.82 CYP4F2 (0.38) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL6745521 0.80 CYP4F2 (0.37) MEN1KMT2AALDH1A1MGLLCYP4F2
SCHEMBL10151162 0.80 CYP4F2 (0.37) MEN1KMT2AALDH1A1MGLLCYP4F2
SCHEMBL6744908 0.80 CYP4F2 (0.37) MEN1KMT2AALDH1A1MGLLTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2374794-B1 CYCLIC AMINE COMPOUNDS DAIICHI SANKYO CO LTD (JP) 2015-11-04 EP disclosed
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 MEN1 1659/4885KMT2A 2928/4885RAB9A 1027/4885
US-20110319359-A1 INDANYL COMPOUNDS RYR2, ORAI1, CASR MEN1 2944/4885KMT2A 4655/4885RAB9A 779/4885

“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.