SCHEMBL25485603

SCHEMBL25485603

COCCO[C@H]1CC[C@H](NC(=O)c2cc(C(F)(F)F)cc(Cl)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CD38 P28907 19/20 0.53
RORC P51449 1/20 0.43

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
SCHEMBL30230489 1.00 CD38 (0.53) CD38RORC
SCHEMBL25485488 0.86 CD38 (0.55) CD38
SCHEMBL30261781 0.86 CD38 (0.55) CD38
SCHEMBL30261772 0.85 CD38 (0.54) CD38
SCHEMBL25489082 0.85 CD38 (0.54) CD38
SCHEMBL25490775 0.84 CD38 (0.53) CD38
SCHEMBL30261777 0.84 CD38 (0.53) CD38
SCHEMBL30261825 0.84 CD38 (0.53) CD38
SCHEMBL25485563 0.84 CD38 (0.53) CD38
SCHEMBL25135975 0.82 CD38 (0.77) CD38

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-20230158024-A1 CD38 INHIBITORS Astellas Engineered Small Molecules US, Incorporated 2023-05-25 US disclosed
US-20230158024-A1 CD38 INHIBITORS Astellas Engineered Small Molecules US, Incorporated 2023-05-25 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-20230158024-A1 CD38 INHIBITORS CD38, NQO1, NDUFAB1 CD38 1/4885RORC 2423/4885

“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.