Cyclohexane

Cyclohexane

SCHEMBL27799754

C1CCCCC1.CC(C)=O.N=C=O.N=C=O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
NFKB1 P19838 1/20 0.32
TSHR P16473 1/20 0.31
THPO P40225 1/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 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
Acetone SCHEMBL27898062 0.89 LMNA (0.55) LMNANFKB1TSHRTHPOFFAR3
Acetone SCHEMBL23501541 0.89
Acetone SCHEMBL9738904 0.89 LMNA (0.55) LMNANFKB1TSHRTHPOFFAR3
Cyclohexane SCHEMBL4893488 0.81 TSHR (0.33) TSHR
Cyclopentane SCHEMBL7267488 0.80 ALDH1A1 (0.30)
Cyclohexane SCHEMBL11564271 0.80 ALDH1A1 (0.30)
Cycloheptane SCHEMBL4048765 0.80 ALDH1A1 (0.30)
Cyclopropane SCHEMBL247293 0.80
Cycloheptane SCHEMBL8811487 0.80 ALDH1A1 (0.30)
Cyclohexane SCHEMBL48514 0.80 ALDH1A1 (0.30)

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
CN-101934067-B Preparation method of polygeline injection WUHAN DONGFANGHONG PHARMACEUTICAL TECHNOLOGY CO LTD 2012-12-26 CN disclosed
CN-101934067-A Preparation method of polygeline injection WUHAN DONGFANGHONG PHARMACEUTICAL TECHNOLOGY CO LTD 2011-01-05 CN disclosed