SCHEMBL22480279

SCHEMBL22480279

Cc1noc(-c2ccc(O[C@@H]3CCC[C@@H](C(=O)O)C3)cc2)c1CNC(=O)OCc1ccccc1

nearest known ligand 0.87

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 6/20 0.87
SLCO1B1 Q9Y6L6 4/20 0.64
SLC6A9 P48067 1/20 0.41
CTSL P07711 4/20 0.38
CTSS P25774 4/20 0.38
CTSK P43235 4/20 0.38
DGAT1 O75907 1/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL22480425 0.93 LPAR1 (0.86) LPAR1SLCO1B1SLC6A9
SCHEMBL22480360 0.93 LPAR1 (1.00) LPAR1SLCO1B1SLC6A9ALDH1A1
SCHEMBL22480277 0.92 LPAR1 (0.82) LPAR1SLCO1B1SLC6A9CTSLCTSS
SCHEMBL22480303 0.92 LPAR1 (0.84) LPAR1SLCO1B1SLC6A9
SCHEMBL22480563 0.91 LPAR1 (0.80) LPAR1SLCO1B1SLC6A9ALDH1A1
SCHEMBL22480291 0.90 LPAR1 (0.74) LPAR1SLCO1B1SLC6A9
SCHEMBL22467564 0.89 LPAR1 (0.88) LPAR1SLCO1B1SLC6A9CTSLCTSS
SCHEMBL22467571 0.89 LPAR1 (0.88) LPAR1SLCO1B1SLC6A9CTSLCTSS
SCHEMBL22467451 0.89 LPAR1 (0.88) LPAR1SLCO1B1SLC6A9CTSLCTSS
SCHEMBL22480374 0.89 LPAR1 (0.76) LPAR1SLCO1B1SLC6A9DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728210-B1 ISOXAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2026-02-11 EP claimed
EP-3728210-B1 ISOXAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2026-02-11 EP disclosed
US-20200308157-A1 ISOXAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2020-10-01 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-20200308157-A1 ISOXAZOLE N-LINKED CARBAMOYL CYCLOHEXYL ACIDS AS LPA ANTAGONISTS LPAR1, LPAR2, LPAR5 LPAR1 1/4885SLCO1B1 1123/4885SLC6A9 1246/4885

“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.