SCHEMBL879975

SCHEMBL879975

CC(=O)Nc1ccc(CCS(=O)(=O)N2CCC3(CC2)N=C([C@H]2CC[C@@H](OCCCF)CC2)NC3=O)c(C)c1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 12/20 0.75
CALCRL Q16602 2/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMYD3 Q9H7B4 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
SCHEMBL13555181 1.00 PTH1R (0.75) PTH1RCALCRLMAPTHSD17B10SMYD3
SCHEMBL849492 1.00 PTH1R (0.75) PTH1RCALCRLMAPTHSD17B10SMYD3
SCHEMBL850691 0.94 PTH1R (0.76) PTH1RCALCRL
SCHEMBL849475 0.92 PTH1R (0.78) PTH1RCALCRLMAPTHSD17B10
SCHEMBL850026 0.91 PTH1R (0.74) PTH1RCALCRLMAPTHSD17B10
SCHEMBL849293 0.90 PTH1R (0.78) PTH1RCALCRLSMYD3
SCHEMBL13555196 0.90 PTH1R (0.78) PTH1RCALCRLSMYD3
SCHEMBL848590 0.89 PTH1R (0.77) PTH1RCALCRLSMYD3
SCHEMBL13555152 0.89 PTH1R (0.82) PTH1RCALCRL
SCHEMBL13555167 0.89 PTH1R (0.82) PTH1RCALCRL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487517-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-08 US disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
US-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-10-25 US disclosed
EP-2433940-A1 SPIROIMIDAZOLONE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2012-03-28 EP disclosed
WO-2010126030-A1 SPIROIMIDAZOLONE DERIVATIVE 中外製薬株式会社 (JP) 2010-11-04 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-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE WNK3, REN, SGK3 PTH1R 1869/4885CALCRL 1957/4885MAPT 3000/4885

“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.