SCHEMBL2383732

SCHEMBL2383732

CS(=O)(=O)OCC(Oc1cccc2ccccc12)[C@@H]1CO1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
KDM4E B2RXH2 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SLC6A4 P31645 8/20 0.36
SLC6A2 P23975 6/20 0.36
SLC6A3 Q01959 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
RAB9A P51151 1/20 0.35
NR2E1 Q9Y466 2/20 0.34
TSHR P16473 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
SCHEMBL2383729 1.00 MEN1 (0.37) MEN1KMT2AKDM4ECYP1A2CYP2C19
SCHEMBL2383804 0.79 TDP1 (0.35) CYP1A2CYP2C19SLC6A2
SCHEMBL2383807 0.79 TDP1 (0.35) CYP1A2CYP2C19SLC6A2
SCHEMBL2383353 0.79 SLC6A2 (0.44) KDM4ECYP1A2ALDH1A1SLC6A4SLC6A2
SCHEMBL2383358 0.79 SLC6A2 (0.44) KDM4ECYP1A2ALDH1A1SLC6A4SLC6A2
SCHEMBL2386602 0.75 FFAR4 (0.39)
SCHEMBL2386597 0.75 FFAR4 (0.39)
SCHEMBL2385217 0.72 CA1 (0.37) MEN1KMT2ACYP1A2CYP2C19SLC6A4
SCHEMBL2385224 0.72 CA1 (0.37) MEN1KMT2ACYP1A2CYP2C19SLC6A4
SCHEMBL28074256 0.70 NR2E1 (0.64) MEN1KMT2AKDM4ECYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293715-B2 10a-Azalide compound crosslinked at 10a- and 12-positions TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-10-23 US disclosed
US-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-29 US disclosed
EP-2177526-A1 10A-AZALIDE COMPOUND CROSSLINKED AT POSITION-10A AND POSITION-12 Taisho Pharmaceutical Co. Ltd. (JP) 2010-04-21 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 (1 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-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS DCLRE1A, AZI2, CHD9 MEN1 3118/4885KMT2A 568/4885KDM4E 64/4885

“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.