SCHEMBL26506199

SCHEMBL26506199

CN(Cc1ccccc1)C(=O)NCC(CC(=O)O)NC(=O)c1c(Cl)cc2c(c1Cl)CCN(Cc1cccc(F)c1)C2=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 1/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.36
▸ KMT2A Q03164 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ POLB P06746 1/20 0.34
▸ AKR1B1 P15121 2/20 0.34
▸ AKR1B10 O60218 1/20 0.34
▸ AKR1A1 P14550 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ DHPS P49366 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ LIPG Q9Y5X9 1/20 0.33
▸ SCD O00767 1/20 0.33

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
SCHEMBL23979038 0.90 ITGB2 (0.41) EGLN1
SCHEMBL23978554 0.90 ITGB2 (0.41) EGLN1
SCHEMBL26478217 0.90 ITGB2 (0.37) EGLN1SMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL26506154 0.88 ITGB2 (0.35) EGLN1SMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL23978842 0.87 LMNA (0.38) EGLN1SMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL24804783 0.87 LMNA (0.38) EGLN1SMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL24804269 0.87 EGLN1 (0.40) EGLN1SMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL23978595 0.84 ITGB2 (0.45) —
SCHEMBL30279298 0.84 ITGB2 (0.45) —
SCHEMBL23979035 0.84 ITGB2 (0.45) —

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-11643388-B2 Inhibitors of alpha 2 beta 1 integrin and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-05-09 — — 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-11643388-B2 Inhibitors of alpha 2 beta 1 integrin and methods of use thereof ITGB1, ITGB2, ITGA2 EGLN1 2305/4885SMN1; SMN2 3098/4885LMNA 2041/4885

“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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