SCHEMBL24970844

SCHEMBL24970844

Cc1ccc(COC(=O)c2cnc(N3CCN(C(=O)OC(C)(C)C)CC3)c(Cl)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 20/20 0.62

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
SCHEMBL24970843 0.94 P2RY12 (0.58) P2RY12
SCHEMBL31142982 0.92 P2RY12 (0.61) P2RY12
SCHEMBL31142854 0.91 P2RY12 (0.62) P2RY12
SCHEMBL907683 0.87 P2RY12 (0.63) P2RY12
SCHEMBL30903385 0.87 P2RY12 (0.63) P2RY12
SCHEMBL24970845 0.84 P2RY12 (0.56) P2RY12
SCHEMBL31143066 0.83 P2RY12 (0.54) P2RY12
SCHEMBL31142871 0.83 P2RY12 (0.62) P2RY12
SCHEMBL24969926 0.82 P2RY12 (0.60) P2RY12
SCHEMBL31143075 0.82 P2RY12 (0.60) P2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240327354-A1 GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS INSTITUT PASTEUR DE LILLE (FR) 2024-10-03 US disclosed
WO-2023002011-A1 GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-01-26 WO 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-20240327354-A1 GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS ABCB11, ABCB1, ATP4B P2RY12 1201/4885

“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.