Cyclohexane

Cyclohexane

SCHEMBL4358222

C1CCCCC1.C=C(C)C(=O)OC(C)O

nearest known ligand 0.43

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
ALDH1A1 P00352 2/20 0.42
THRB P10828 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL20364 0.93
SCHEMBL10762910 0.93
SCHEMBL27553112 0.93 TSHR (0.48) TSHRALDH1A1THRBTDP1
SCHEMBL11125870 0.93
SCHEMBL28173721 0.91 TSHR (0.46) TSHRALDH1A1THRBTDP1
Methane SCHEMBL27883200 0.91 TSHR (0.46) TSHRALDH1A1THRBTDP1
Water SCHEMBL10713209 0.91 TSHR (0.46) TSHRALDH1A1THRBTDP1
SCHEMBL28133850 0.91 TSHR (0.46) TSHRALDH1A1THRBTDP1
SCHEMBL20701419 0.91 TSHR (0.46) TSHRALDH1A1THRBTDP1
Ethylene SCHEMBL8934253 0.91 TSHR (0.46) TSHRALDH1A1THRBTDP1

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
US-8293046-B2 Process for production of porous body and uses thereof JMS CO., LTD. (JP) 2012-10-23 US disclosed
US-20090319016-A1 PROCESS FOR PRODUCTION OF POROUS BODY AND USES THEREOF JMS CO., LTD. (JP) 2009-12-24 US disclosed
EP-2100915-A1 PROCESS FOR PRODUCTION OF POROUS BODY AND USES THEREOF JMS Co., Ltd. (JP) 2009-09-16 EP disclosed