SCHEMBL23126003

SCHEMBL23126003

CC(=O)NC1C(O)[C@H](O[C@@H]2OC(CO)[C@H](O)C(O[C@H]3OC(CO)[C@H](O)C(O)C3O)C2O)C(CO)O[C@H]1OCCCNC(=O)CCCCC(=O)NCc1cccc(C(=O)NCCNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]32)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPSE Q9Y251 2/20 0.57
▸ FGF1 P05230 1/20 0.57
▸ FGF2 P09038 1/20 0.57
▸ VEGFA P15692 1/20 0.57
▸ MDK P21741 4/20 0.57
▸ LGALS3 P17931 2/20 0.42
▸ LGALS8 O00214 1/20 0.42
▸ LGALS4 P56470 1/20 0.42
▸ ITGB1 P05556 1/20 0.41
▸ ITGA4 P13612 1/20 0.41
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ FOLH1 Q04609 2/20 0.38
▸ GIGYF2 Q6Y7W6 1/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ PLCD1 P51178 1/20 0.38
▸ NSD2 O96028 1/20 0.38
▸ NSD3 Q9BZ95 1/20 0.38

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
SCHEMBL18705327 0.96 MDK (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL24067561 0.96 MDK (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL24067560 0.96 MDK (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL23126167 0.96 MDK (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL23126027 0.92 FGF1 (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL23126139 0.92 HPSE (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL20519908 0.92 HPSE (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL24067580 0.92 HPSE (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL24067582 0.92 HPSE (0.56) HPSEFGF1FGF2VEGFAMDK
SCHEMBL24067597 0.92 HPSE (0.56) HPSEFGF1FGF2VEGFAMDK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10953100-B2 Compounds and therapeutic uses thereof CENTUARI THERAPEUTICS LIMITED (GB/GB) (GB) 2021-03-23 — — 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-10953100-B2 Compounds and therapeutic uses thereof CD47, MYD88, NFATC1 HPSE 762/4885FGF1 4232/4885FGF2 4081/4885

“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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