SCHEMBL29948416

SCHEMBL29948416

CCCn1nnc(Br)c1NC(=O)O[C@H](C)c1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 16/20 0.57
LPAR3 Q9UBY5 4/20 0.41
LPAR2 Q9HBW0 2/20 0.41
ENPP2 Q13822 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL23384396 1.00 LPAR1 (0.57) LPAR1LPAR3LPAR2ENPP2ALDH1A1
SCHEMBL23384065 0.86 LPAR1 (0.62) LPAR1LPAR3LPAR2
SCHEMBL29948360 0.86 LPAR1 (0.62) LPAR1LPAR3LPAR2
SCHEMBL14712128 0.78 LPAR1 (0.58) LPAR1LPAR3LPAR2ENPP2ALDH1A1
SCHEMBL29908077 0.77 LPAR1 (0.59) LPAR1LPAR3LPAR2
SCHEMBL23384181 0.77 LPAR1 (0.42) LPAR1LPAR3LPAR2ENPP2ALDH1A1
SCHEMBL30482805 0.77 LPAR1 (0.42) LPAR1LPAR3LPAR2ENPP2ALDH1A1
SCHEMBL12989052 0.76 LPAR1 (0.73) LPAR1LPAR3LPAR2
SCHEMBL30005304 0.76 LPAR1 (0.73) LPAR1LPAR3LPAR2
SCHEMBL12990132 0.74 LPAR1 (0.86) LPAR1LPAR3LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999717-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2024-06-04 US disclosed
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-11548871-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2023-01-10 US disclosed
EP-4058144-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF Gilead Sciences, Inc. (US) 2022-09-21 EP 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 (3 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-11548871-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof LPAR3, LPAR1, LPAR2 LPAR1 2/4885LPAR3 1/4885LPAR2 3/4885
US-11999717-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof LPAR3, LPAR1, LPAR2 LPAR1 2/4885LPAR3 1/4885LPAR2 3/4885
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR3, LPAR1, LPAR2 LPAR1 2/4885LPAR3 1/4885LPAR2 3/4885

“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.