SCHEMBL19221012

SCHEMBL19221012

CC(C)OC1OC(C(=O)O)[C@@H](OC2OC(C(=O)O)[C@@H](OC(C)C)[C@H](O)C2O)[C@H](O)C1O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FGF1 P05230 1/20 0.37
▸ AKT1 P31749 1/20 0.36
▸ CXCL10 P02778 1/20 0.34
▸ CXCL8 P10145 1/20 0.34
▸ CCL2 P13500 1/20 0.34
▸ CCL5 P13501 1/20 0.34
▸ CXCL12 P48061 1/20 0.34
▸ F10 P00742 2/20 0.33
▸ BDNF P23560 3/20 0.32
▸ PTN P21246 2/20 0.32
▸ MDK P21741 2/20 0.32
▸ LMNA P02545 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
SCHEMBL11994264 1.00 FGF1 (0.37) FGF1AKT1CXCL10CXCL8CCL2
SCHEMBL19220864 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL14212353 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL14212363 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL11994265 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL23710806 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL19220861 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL14212365 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL19221011 0.94 AKT1 (0.39) FGF1AKT1
SCHEMBL19220857 0.94 AKT1 (0.39) FGF1AKT1

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-20170239397-A1 MODIFIED ALGINATES FOR ANTI-FIBROTIC MATERIALS AND APPLICATIONS UNITED STATES GOVERNMENT 2017-08-24 — — US disclosed
US-20170226232-A1 MODIFIED ALGINATES FOR ANTI-FIBROTIC MATERIALS AND APPLICATIONS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2017-08-10 — — 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 (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-20170226232-A1 MODIFIED ALGINATES FOR ANTI-FIBROTIC MATERIALS AND APPLICATIONS ALG1, FIBP, COL2A1 FGF1 386/4885AKT1 4642/4885CXCL10 421/4885
US-20170239397-A1 MODIFIED ALGINATES FOR ANTI-FIBROTIC MATERIALS AND APPLICATIONS ALG1, FIBP, COL2A1 FGF1 386/4885AKT1 4642/4885CXCL10 421/4885

“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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