SCHEMBL849068

SCHEMBL849068

Cc1cc(CN(CCO[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C)ccc1Br

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.41
HDAC1 Q13547 4/20 0.36
HDAC3 O15379 3/20 0.36
HDAC2 Q92769 3/20 0.36
NCOR2 Q9Y618 3/20 0.36
POLB P06746 1/20 0.33
ADRB3 P13945 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GRM2 Q14416 1/20 0.30
BACE1 P56817 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL16794210 0.85 SSTR4 (0.42) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL13555125 0.83 SSTR4 (0.54) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL14185973 0.81 HDAC3 (0.47) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL4071560 0.80 SSTR4 (0.41) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL849436 0.80 LMNA (0.43) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL31226424 0.80 SSTR4 (0.37) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL16358311 0.79
SCHEMBL31683136 0.78 PTGER2 (0.42) SSTR4HDAC1HDAC3HDAC2NCOR2
Lithium Ion SCHEMBL30836590 0.78 SSTR4 (0.32) SSTR4HDAC1HDAC3HDAC2NCOR2
SCHEMBL30836783 0.78 ADRB3 (0.33) SSTR4HDAC1HDAC3HDAC2NCOR2

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 14 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-9487517-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-08 US disclosed
US-9487517-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-08 US disclosed
US-20160016956-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-01-21 US disclosed
EP-2433940-B9 SPIROIMIDAZOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2015-10-28 EP disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
EP-2433940-B1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2014-09-24 EP disclosed
US-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-10-25 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
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 (2 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 SSTR4 92/4885HDAC1 71/4885HDAC3 23/4885
US-20160016956-A1 SPIROIMIDAZOLONE DERIVATIVE WNK3, REN, SGK3 SSTR4 92/4885HDAC1 71/4885HDAC3 23/4885

“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.