SCHEMBL5575172

SCHEMBL5575172

O=C1C[C@@H]2[C@@H](/C(O)=C\CCCc3ccccc3)[C@H](OC(=O)c3ccc(-c4ccccc4)cc3)C[C@@H]2O1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.64
▸ KDM4E B2RXH2 1/20 0.64
▸ NPC1 O15118 1/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ BCHE P06276 2/20 0.39
▸ SENP1 Q9P0U3 1/20 0.37
▸ CHRNB2 P17787 2/20 0.35
▸ CHRNB4 P30926 2/20 0.35
▸ CHRNA3 P32297 2/20 0.35
▸ CHRNA4 P43681 2/20 0.35
▸ GPR52 Q9Y2T5 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
SCHEMBL3827791 0.94 RAB9A (0.55) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL1366222 0.85 RAB9A (0.55) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL4533210 0.85 RAB9A (0.55) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL18532429 0.84 RAB9A (0.64) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL9122250 0.80 RAB9A (0.70) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL11215847 0.80 RAB9A (0.53) RAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL11215851 0.80 RAB9A (0.53) RAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL15074495 0.78 RAB9A (1.00) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL8413323 0.78 RAB9A (1.00) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL9208852 0.78 RAB9A (1.00) RAB9AKDM4ENPC1SMN1; SMN2BCHE

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-7166730-B2 Process for the preparation of prostaglandin derivatives FINE TECH LABORATORIES, LTD (IL) 2007-01-23 — — US disclosed
US-20050209337-A1 Process for the preparation of prostaglandin derivatives FINETECH LABORATORIES LTD 2005-09-22 — — 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-20050209337-A1 Process for the preparation of prostaglandin derivatives PTGIS, PTGES, PTGIR RAB9A 3807/4885KDM4E 4475/4885NPC1 2047/4885

“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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