SCHEMBL879884

SCHEMBL879884

CC1(CCCCCCCCCCCOCc2ccccc2)COC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 1/20 0.42
EPHX2 P34913 2/20 0.41
TSHR P16473 1/20 0.40
GBA1 P04062 3/20 0.39
UGCG Q16739 2/20 0.39
GBA2 Q9HCG7 2/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
SPHK1 Q9NYA1 2/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
PSMB11 A5LHX3 1/20 0.36
PSMD11 O00231 1/20 0.36
PSMD12 O00232 1/20 0.36
PSMD14 O00487 1/20 0.36
PSMA7 O14818 1/20 0.36

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
SCHEMBL851490 1.00 SOAT1 (0.54) SOAT1L3MBTL1TDP1ALDH1A1EPHX2
SCHEMBL27274916 0.84 L3MBTL1 (0.48) SOAT1L3MBTL1TDP1ALDH1A1EPHX2
SCHEMBL5423335 0.78 TSHR (0.48) SOAT1ALDH1A1TSHRMEN1KMT2A
SCHEMBL9182822 0.78 L3MBTL1 (0.48) SOAT1L3MBTL1TDP1ALDH1A1EPHX2
SCHEMBL11019198 0.77 ALDH1A1 (0.44) SOAT1L3MBTL1TDP1ALDH1A1EPHX2
SCHEMBL9011624 0.77 TSHR (0.67) L3MBTL1TDP1EPHX2TSHRGBA1
SCHEMBL9011646 0.77 TSHR (0.67) L3MBTL1TDP1EPHX2TSHRGBA1
SCHEMBL9011734 0.77 TSHR (0.67) L3MBTL1TDP1EPHX2TSHRGBA1
SCHEMBL9011715 0.77 TSHR (0.67) L3MBTL1TDP1EPHX2TSHRGBA1
SCHEMBL879875 0.75 UGCG (0.43) SOAT1L3MBTL1TDP1EPHX2TSHR

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 10 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
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
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
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 SOAT1 3641/4885L3MBTL1 4219/4885TDP1 3062/4885

“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.