Cyclohexane

Cyclohexane

SCHEMBL5712062

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nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
TSHR P16473 1/20 0.33

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
Cyclohexane SCHEMBL12475625 1.00 ALDH1A1 (0.57) ALDH1A1TSHR
Cyclopentane SCHEMBL29088065 1.00
Cyclohexane SCHEMBL21879029 1.00 ALDH1A1 (0.57) ALDH1A1TSHR
Cyclohexane SCHEMBL11489570 1.00 ALDH1A1 (0.57) ALDH1A1TSHR
Cyclohexane SCHEMBL12475806 1.00 ALDH1A1 (0.57) ALDH1A1TSHR
Cyclohexane SCHEMBL12476090 1.00 ALDH1A1 (0.57) ALDH1A1TSHR
Cyclohexane SCHEMBL185456 1.00
Cyclohexane SCHEMBL2166732 0.94 ALDH1A1 (0.50) ALDH1A1TSHR
Cyclohexane SCHEMBL11683239 0.84 ALDH1A1 (0.40) ALDH1A1TSHR
Cyclohexane SCHEMBL4728225 0.84 ALDH1A1 (0.40) ALDH1A1TSHR

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-1732938-A1 ORGANOPHOSPHOROUS INDAZOLE DERIVATIVES AND USE THEREOF AS PROTEIN KINASE INHIBITORS Aventis Pharma S.A. (FR) 2006-12-20 EP disclosed
WO-2005058923-A1 ORGANOPHOSPHOROUS INDAZOLE DERIVATIVES AND USE THEREOF AS PROTEIN KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2005-06-30 WO disclosed