SCHEMBL23915330

SCHEMBL23915330

CC(C)(C)OC(=O)Cn1nc(Cc2nc3cc(Cl)c(OCC(F)F)cc3[nH]2)c2c(c1=O)CCCC2

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 9/20 0.56
RHEB Q15382 1/20 0.34
MAPT P10636 1/20 0.30
TP53 P04637 1/20 0.30
PLA2G7 Q13093 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
SCHEMBL23915346 0.91 S1PR2 (0.55) S1PR2RHEB
SCHEMBL23914851 0.90 S1PR2 (0.49) S1PR2PLA2G7
SCHEMBL23908873 0.90 S1PR2 (0.68) S1PR2RHEBMAPT
SCHEMBL23915331 0.89 S1PR2 (0.55) S1PR2RHEBMAPTTP53PLA2G7
SCHEMBL23915327 0.89 S1PR2 (0.54) S1PR2RHEBMAPTTP53
SCHEMBL23914605 0.88 S1PR2 (0.57) S1PR2RHEB
SCHEMBL23914694 0.86 S1PR2 (0.76) S1PR2TP53
SCHEMBL23914704 0.82 S1PR2 (0.62) S1PR2RHEB
SCHEMBL23966580 0.82 S1PR2 (0.55) S1PR2RHEBMAPT
SCHEMBL23908754 0.81 S1PR2 (0.67) S1PR2RHEB

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
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
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 3/4885RHEB 2911/4885MAPT 4876/4885

“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.