Cyclohexane

Cyclohexane

SCHEMBL27411147

C1CCCCC1.CC(C)C

nearest known ligand 0.43

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 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
Cyclopentane SCHEMBL20394153 1.00
SCHEMBL3685908 0.80 ALDH1A1 (0.62) TDP1ALDH1A1TSHRHSD17B10
Isobutane SCHEMBL21407902 0.76
Cyclopentane SCHEMBL9633785 0.76
Isobutane SCHEMBL20490082 0.76 TSHR (0.50) TDP1ALDH1A1TSHRHSD17B10LMNA
Isobutane SCHEMBL768 0.76
Cyclopropane SCHEMBL4456701 0.76
Cyclohexane SCHEMBL6514805 0.76 ALDH1A1 (0.36) TDP1ALDH1A1TSHR
Cyclopentane SCHEMBL11650938 0.76
Isobutane SCHEMBL7754023 0.76 TSHR (0.50) TDP1ALDH1A1TSHRHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1093778-C Method for stabilizing catalyst system for olefin production PHILLIPS PETROLEUM CO (US) 2002-11-06 CN disclosed
CN-1090535-C Olefin production PHILLIPS PETROLEUM CO (US) 2002-09-11 CN disclosed
CN-1108967-A Process for the production of olefins PHILLIPS PETROLEUM CO (US) 1995-09-27 CN disclosed