SCHEMBL24983474

SCHEMBL24983474

CCCCC(C)(CC)OC1C(I)C(CO)O[C@@H](O[C@H]2C(C(=O)O)O[C@@H](C(C)(CC)CCCC)[C@@H](O)C2O)C1NC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.36
▸ MDK P21741 4/20 0.35
▸ BDNF P23560 3/20 0.35
▸ PTN P21246 2/20 0.35
▸ LGALS3 P17931 3/20 0.34
▸ LGALS8 O00214 1/20 0.34
▸ LGALS4 P56470 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ CD69 Q07108 1/20 0.34
▸ FGF1 P05230 1/20 0.33
▸ CHIA Q9BZP6 1/20 0.33
▸ BMP2 P12643 1/20 0.32
▸ VEGFA P15692 1/20 0.32
▸ CXCL12 P48061 1/20 0.32
▸ SHH Q15465 1/20 0.32
▸ TLR4 O00206 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
SCHEMBL24952165 0.88 MAPK1 (0.39) MAPK1MDKBDNFPTNLGALS3
SCHEMBL18737419 0.87 MDK (0.41) MAPK1MDKBDNFPTNLGALS3
SCHEMBL24952163 0.87 BDNF (0.37) MAPK1MDKBDNFPTNLGALS3
SCHEMBL24952164 0.85 MAPK1 (0.31) MAPK1MDKBDNFPTNCD69
SCHEMBL20122306 0.81 LGALS3 (0.39) MAPK1MDKBDNFPTNLGALS3
SCHEMBL24121225 0.77 LGALS3 (0.39) MAPK1MDKBDNFPTNLGALS3
SCHEMBL22598693 0.75 MDK (0.45) MAPK1MDKBDNFPTNLGALS3
SCHEMBL23343406 0.74 MDK (0.36) MAPK1MDKBDNFPTNLGALS3
SCHEMBL21480237 0.73 LGALS3 (0.44) MAPK1MDKBDNFPTNLGALS3
SCHEMBL21316642 0.73 LGALS3 (0.42) MAPK1MDKBDNFPTNLGALS3

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-20230021037-A1 HYDROGEL OF MERCAPTO-MODIFIED MACROMOLECULAR COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Blafar Biotechnology (Hangzhou) Ltd (CN) 2023-01-19 — — 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-20230021037-A1 HYDROGEL OF MERCAPTO-MODIFIED MACROMOLECULAR COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF NOTUM, MGMT, CTH MAPK1 3345/4885MDK 681/4885BDNF 4416/4885

“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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