SCHEMBL14029548

SCHEMBL14029548

Cc1cc2c(-c3c(C)c(C)c(C)c(C)c3C)c3cc(C)c(=O)c(C)c-3oc2c(C)c1C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ CA12 O43570 1/20 0.30
▸ CA9 Q16790 1/20 0.30
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 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
SCHEMBL13996420 0.77 THRB (0.51) TSHRHTT
SCHEMBL14878846 0.73 KDM4E (0.43) TSHRHTTCA12CA9
SCHEMBL15483898 0.72 ESR1 (0.38) HTTCA12CA9MAOB
SCHEMBL14134418 0.67 ADORA3 (0.32) —
SCHEMBL11976508 0.66 MAOB (0.35) TSHRMAPK1HTTMAOAMAOB
SCHEMBL14286794 0.62 ALOX5 (0.37) TSHR
SCHEMBL862631 0.61 TSHR (0.33) TSHRMAPK1HTT
SCHEMBL25763125 0.61 ALDH1A1 (0.47) TSHRMAPK1HTTMAOAMAOB
SCHEMBL13308662 0.60 GLA (0.46) MAOA
SCHEMBL11401650 0.59 TDP2 (0.37) TSHRMAPK1MAOAMAOB

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
US-8460877-B2 Based on degree of coloring in liquid sample mixed with indicator; xanthene dyes; immunoassay; for detecting creatine concentrations ARKRAY, INC. (JP) 2013-06-11 — — US disclosed
US-20080241850-A1 Method of Protein Measurement ARKRAY, INC. (JP) 2008-10-02 — — US disclosed
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