Cyclohexane

Cyclohexane

SCHEMBL29068487

C1CCCCC1.CO.CO.O=C1OCCOC(=O)c2ccc1cc2

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
ITGB2 P05107 1/20 0.35
ICAM1 P05362 1/20 0.35
ITGAL P20701 1/20 0.35
SMN1; SMN2 Q16637 5/20 0.34
GAA P10253 2/20 0.34
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.32
CLK1 P49759 1/20 0.32
DYRK1A Q13627 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
ALOX5 P09917 1/20 0.31
PGR P06401 2/20 0.31
HTT P42858 2/20 0.31
LMNA P02545 2/20 0.31
CRHBP P24387 2/20 0.31

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
Methyl Alcohol SCHEMBL29170933 0.93 PGR (0.36) MAOAMAOBALDH1A1NPC1RAB9A
Cyclohexane SCHEMBL483591 0.93 ITGB2 (0.39) MAOAMAOBITGB2ICAM1ITGAL
SCHEMBL3874923 0.87 ITGB2 (0.43) MAOAMAOBITGB2ICAM1ITGAL
SCHEMBL22419 0.87 ITGB2 (0.43) MAOAMAOBITGB2ICAM1ITGAL
SCHEMBL17628649 0.87 ITGB2 (0.43) MAOAMAOBITGB2ICAM1ITGAL
SCHEMBL4157033 0.85 CA1 (0.40) ITGB2ICAM1ITGALALDH1A1KMT2A
SCHEMBL2483184 0.85 CA1 (0.40) ITGB2ICAM1ITGALALDH1A1KMT2A
SCHEMBL3174046 0.85 CA1 (0.40) ITGB2ICAM1ITGALALDH1A1KMT2A
SCHEMBL1235004 0.85 ITGB2 (0.38) ITGB2ICAM1ITGALSMN1; SMN2GAA
SCHEMBL597282 0.85 CA1 (0.40) ITGB2ICAM1ITGALALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116745115-A Laminate, card and case 索尼集团公司 2023-09-12 CN disclosed