SCHEMBL23915546

SCHEMBL23915546

COC(=O)Cc1nn(CC2=CC3C=C(Cl)C(OCC4CC4)=CC3N2COCC[Si](C)(C)C)c2ccccc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 10/20 0.41
DGAT1 O75907 1/20 0.31
NPC1 O15118 1/20 0.30

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
SCHEMBL23915548 0.91 S1PR2 (0.41) S1PR2
SCHEMBL23908923 0.76 S1PR2 (0.51) S1PR2DGAT1NPC1
SCHEMBL23909037 0.75 NPC1 (0.44) S1PR2NPC1
SCHEMBL23914864 0.72 S1PR2 (0.43) S1PR2DGAT1NPC1
SCHEMBL23909024 0.69 S1PR2 (0.59) S1PR2NPC1
SCHEMBL28381362 0.68 NPC1 (0.42) NPC1
SCHEMBL23915483 0.67 S1PR2 (0.85) S1PR2
SCHEMBL23908911 0.66 MAPT (0.45) S1PR2NPC1
SCHEMBL23914498 0.64 KDM4E (0.41) S1PR2
SCHEMBL23914662 0.64 DGAT1 (0.36) DGAT1NPC1

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-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 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-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS S1PR1, S1PR3, S1PR2 S1PR2 3/4885DGAT1 1128/4885NPC1 467/4885

“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.