SCHEMBL8060426

SCHEMBL8060426

COC(=O)C(O)CC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
TDP1 Q9NUW8 2/20 0.42
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
KMT2A Q03164 2/20 0.34
CA14 Q9ULX7 2/20 0.33
ZDHHC7 Q9NXF8 1/20 0.32
TSHR P16473 1/20 0.32
CA12 O43570 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ESRRB O95718 1/20 0.30

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
SCHEMBL8060423 1.00 ALDH1A1 (0.42) ALDH1A1TDP1MGAMGAASI
SCHEMBL1691025 0.80 TSHR (0.43) MGAMGAASIMGAM2SMN1; SMN2
SCHEMBL206973 0.80 SMN1; SMN2 (0.52) TDP1SMN1; SMN2CA1CA2KMT2A
SCHEMBL1823637 0.80 TSHR (0.43) MGAMGAASIMGAM2SMN1; SMN2
SCHEMBL222024 0.80 SMN1; SMN2 (0.52) TDP1SMN1; SMN2CA1CA2KMT2A
SCHEMBL205700 0.80 TSHR (0.43) MGAMGAASIMGAM2SMN1; SMN2
SCHEMBL9040323 0.80 SMN1; SMN2 (0.52) TDP1SMN1; SMN2CA1CA2KMT2A
SCHEMBL6061378 0.78 TSHR (0.42) MGAMGAASIMGAM2SMN1; SMN2
SCHEMBL7491734 0.78 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2CA1CA2KMT2A
Ammonia Solution, Strong SCHEMBL21219123 0.78 SMN1; SMN2 (0.50) TDP1SMN1; SMN2CA1CA2KMT2A

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
US-20150374661-A1 BIOLOGICALLY ACTIVE MACROLIDES, COMPOSITIONS, AND USES THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERV (US) 2015-12-31 US disclosed
US-9139595-B2 Biologically active macrolides, compositions, and uses thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-09-22 US disclosed
US-20140243284-A1 BIOLOGICALLY ACTIVE MACROLIDES, COMPOSITIONS, AND USES THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERV (US) 2014-08-28 US disclosed
US-8741947-B2 Biologically active macrolides, compositions, and uses thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2014-06-03 US disclosed
EP-0620857-B1 SYNTHESIS OF HOMOCHIRAL 2-HYDROXY ACIDS GENZYME LTD (GB) 2000-08-02 EP disclosed
US-5686275-A LACTATE DEHYDROGENASE GENZYME LTD. (GB) 1997-11-11 US disclosed
US-5434289-A Process for producing optically active β-hydroxyketone TAKASAGO INTERNATIONAL CORPORATION (JP) 1995-07-18 US disclosed
EP-0620857-A1 SYNTHESIS OF HOMOCHIRAL 2-HYDROXY ACIDS Genzyme Limited (GB) 1994-10-26 EP disclosed
WO-1993013215-A1 SYNTHESIS OF HOMOCHIRAL 2-HYDROXY ACIDS GENZYME LIMITED (GB) 1993-07-08 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-20140243284-A1 BIOLOGICALLY ACTIVE MACROLIDES, COMPOSITIONS, AND USES THEREOF ABCC9, ABCB11, ATP6V1H ALDH1A1 3266/4885TDP1 3924/4885MGAM 1239/4885
US-20150374661-A1 BIOLOGICALLY ACTIVE MACROLIDES, COMPOSITIONS, AND USES THEREOF ABCC9, ABCB11, ATP6V1H ALDH1A1 3266/4885TDP1 3924/4885MGAM 1239/4885

“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.