SCHEMBL13627273

SCHEMBL13627273

COC(OC)C1[C@H]2CC(=O)O[C@H]2C[C@H]1OC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GABRA1 P14867 2/20 0.33
GABRB2 P47870 2/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
ALOX5 P09917 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
PRKCA P17252 5/20 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
SCHEMBL12087568 1.00 RAB9A (0.37) RAB9AKDM4ENPC1SMN1; SMN2GABRA1
SCHEMBL16976910 1.00 RAB9A (0.37) RAB9AKDM4ENPC1SMN1; SMN2GABRA1
SCHEMBL12087571 0.79 THRB (0.40) RAB9AKDM4ENPC1SMN1; SMN2THRB
SCHEMBL16976913 0.79 THRB (0.40) RAB9AKDM4ENPC1SMN1; SMN2THRB
SCHEMBL13627274 0.79 THRB (0.40) RAB9AKDM4ENPC1SMN1; SMN2THRB
SCHEMBL11300063 0.77 SMN1; SMN2 (0.35) SMN1; SMN2THRBALOX15
SCHEMBL11299412 0.77 SMN1; SMN2 (0.35) SMN1; SMN2THRBALOX15
SCHEMBL13637440 0.77 SMN1; SMN2 (0.35) SMN1; SMN2THRBALOX15
SCHEMBL12087567 0.76 RAB9A (0.41) RAB9AKDM4ENPC1SMN1; SMN2GABRA1
SCHEMBL16976911 0.76 RAB9A (0.41) RAB9AKDM4ENPC1SMN1; SMN2GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090287003-A1 Process for the production of intermediates for making prostaglandin derivatives such as latanaprost, travaprost, and bimatoprost EASTAR CHEMICAL, INC. 2009-11-19 US disclosed
US-20090287003-A1 Process for the production of intermediates for making prostaglandin derivatives such as latanaprost, travaprost, and bimatoprost EASTAR CHEMICAL, INC. 2009-11-19 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 (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-20090287003-A1 Process for the production of intermediates for making prostaglandin derivatives such as latanaprost, travaprost, and bimatoprost PTGIS, PTGES, PTGES2 RAB9A 3625/4885KDM4E 4021/4885NPC1 4212/4885

“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.