SCHEMBL1685304

SCHEMBL1685304

O=C(C=C(I)[C@@H]1[C@H]2CC(=O)O[C@H]2C[C@H]1OC(=O)c1ccccc1)CCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ OPRM1 P35372 1/20 0.36
▸ OPRD1 P41143 1/20 0.36
▸ CHRNA7 P36544 1/20 0.35

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
SCHEMBL4337459 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL29004578 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL4337454 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL29004577 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL13614205 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL4617880 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL10071672 0.83 RAB9A (0.54) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL4338815 0.80 RAB9A (0.47) RAB9AKDM4ENPC1SMN1; SMN2OPRM1
SCHEMBL3827791 0.80 RAB9A (0.55) RAB9AKDM4ENPC1SMN1; SMN2CHRNA7
SCHEMBL11215847 0.79 RAB9A (0.53) RAB9AKDM4ENPC1SMN1; SMN2CHRNA7

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
EP-2311820-A1 Process for the purification of latanoprost by HPLC Resolution Chemicals Limited (GB) 2011-04-20 — — EP disclosed
US-7498458-B2 Process for the preparation of prostaglandins and analogues thereof RESOLUTION CHEMICALS LIMITED (GB) 2009-03-03 — — US disclosed
US-20050261374-A1 Process for the preparation of prostaglandins and analogues thereof RESOLUTION CHEMICALS LIMITED 2005-11-24 — — 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-20050261374-A1 Process for the preparation of prostaglandins and analogues thereof PTGIS, PTGES, PTGES2 RAB9A 3497/4885KDM4E 4075/4885NPC1 3399/4885

“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.

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