SCHEMBL246889

SCHEMBL246889

C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)CC[C@@H](C)[C@H]5CCC6C7C(CC[C@@]65C)[C@@]5(C)CC[C@@H](O)CC5C[C@H]7O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 7/20 0.71
NR1H4 Q96RI1 5/20 0.71
SLC10A2 Q12908 3/20 0.71
PDE3A Q14432 2/20 0.71
TBXA2R P21731 1/20 0.71
CYP3A4 P08684 3/20 0.68
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
LMNA P02545 3/20 0.67
TDP1 Q9NUW8 3/20 0.67
ABCB11 O95342 2/20 0.67
CYP2C19 P33261 1/20 0.67
CHRM2 P08172 1/20 0.67
ADRA2A P08913 1/20 0.67
ADRA1A P35348 1/20 0.67
ENPP2 Q13822 1/20 0.67
SLC10A1 Q14973 1/20 0.67
CISD1 Q9NZ45 1/20 0.67
MAPT P10636 3/20 0.66
MAPK1 P28482 3/20 0.66

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
SCHEMBL7546767 1.00 GPBAR1 (0.71) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL2369521 1.00 GPBAR1 (0.71) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL1758946 0.96 GPBAR1 (0.67) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL2467588 0.96 GPBAR1 (0.72) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL25791216 0.96 GPBAR1 (0.75) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL25791236 0.96 GPBAR1 (0.75) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL2637801 0.96 GPBAR1 (0.75) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL8646650 0.95 GPBAR1 (0.66) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL2323981 0.94 GPBAR1 (0.78) GPBAR1NR1H4SLC10A2PDE3ATBXA2R
SCHEMBL1287858 0.93 GPBAR1 (0.78) GPBAR1NR1H4SLC10A2PDE3ACYP3A4

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101480402-B Cycloartenyl ferulate pharmaceutical composition and preparation method thereof BEIJING CENTURY BIOCOM PHARMACEUTICAL TECHNOLOGYCO LTD 2012-05-23 CN claimed
US-20240216467-A1 DOSAGE REGIME FOR APOLIPOPROTEIN FORMULATIONS CSL LTD (AU) 2024-07-04 US disclosed
US-11732028-B2 Contaminant removal method CSL LIMITED (AU) 2023-08-22 US disclosed
US-11723953-B2 Reconstituted high density lipoprotein formulation and production method thereof CSL LIMITED (AU) 2023-08-15 US disclosed
EP-2793913-B1 DOSAGE REGIME FOR APOLIPOPROTEIN FORMULATIONS CSL LTD (AU) 2023-06-21 EP disclosed
US-11427869-B2 T cell balance gene expression, compositions of matters and methods of use thereof THE BROAD INSTITUTE, INC. (US) 2022-08-30 US disclosed
US-20220133852-A1 RECONSTITUTED HIGH DENSITY LIPOPROTEIN FORMULATION AND PRODUCTION METHOD THEREOF CSL LIMITED (AU) 2022-05-05 US disclosed
US-11058747-B2 Reconstituted high density lipoprotein formulation and production method thereof CSL LIMITED (AU) 2021-07-13 US disclosed
US-20210147509-A1 CONTAMINANT REMOVAL METHOD CSL LIMITED (AU) 2021-05-20 US disclosed
US-10730927-B2 Contaminant removal method CSL LIMITED (AU) 2020-08-04 US disclosed
US-20140378376-A1 Dosage Regime for Apolipoprotein Formulations CSL LIMITED (AU) 2014-12-25 US disclosed
EP-2793913-A1 DOSAGE REGIME FOR APOLIPOPROTEIN FORMULATIONS CSL Limited (AU) 2014-10-29 EP disclosed
US-20130190226-A1 RECONSTITUTED HIGH DENSITY LIPOPROTEIN FORMULATION AND PRODUCTION METHOD THEREOF CSL LIMITED 2013-07-25 US disclosed
WO-2013090978-A1 DOSAGE REGIME FOR APOLIPOPROTEIN FORMULATIONS CSL LIMITED (AU) 2013-06-27 WO disclosed
EP-2588113-A1 A RECONSTITUTED HIGH DENSITY LIPOPROTEIN FORMULATION AND PRODUCTION METHOD THEREOF CSL Limited (AU) 2013-05-08 EP disclosed
WO-2012000048-A1 A RECONSTITUTED HIGH DENSITY LIPOPROTEIN FORMULATION AND PRODUCTION METHOD THEREOF CSL LIMITED (AU) 2012-01-05 WO disclosed
US-20090105461-A1 Calicheamicin conjugates WYETH (US) 2009-04-23 US disclosed
EP-1740216-A2 ANTIBODY CALICHEAMICIN CONJUGATES Wyeth a Corporation of the State of Delaware (US) 2007-01-10 EP disclosed
US-20060002942-A1 Calicheamicin conjugates WYETH (US) 2006-01-05 US disclosed
WO-2005089808-A2 ANTIBODY CALICHEAMICIN CONJUGATES WYETH (US) 2005-09-29 WO 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-20060002942-A1 Calicheamicin conjugates CLSPN, CALU, CALR GPBAR1 3701/4885NR1H4 2871/4885SLC10A2 1280/4885
US-20090105461-A1 Calicheamicin conjugates CLSPN, CALU, CALR GPBAR1 3701/4885NR1H4 2871/4885SLC10A2 1280/4885

“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.