Cyclohexane

Cyclohexane

SCHEMBL10693974

C1CCCCC1.CC(C)(CN)CN.N.N

nearest known ligand 0.71

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Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.71
KDM4E B2RXH2 1/20 0.38

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
Ammonia Solution, Strong SCHEMBL4612126 0.89
Ammonia Solution, Strong SCHEMBL28206425 0.89
SCHEMBL42682 0.84
Hydrochloric Acid SCHEMBL7047737 0.81
SCHEMBL4204702 0.81
Hydrochloric Acid SCHEMBL9543054 0.81
Cyclohexane SCHEMBL17492352 0.79 CYP2D6 (0.41) CYP2D6
SCHEMBL11120976 0.78 CYP2D6 (0.50) CYP2D6KDM4E
Propane SCHEMBL18640695 0.77 CYP2D6 (0.83) CYP2D6KDM4E
SCHEMBL28598260 0.74 CYP2D6 (0.77) CYP2D6KDM4E

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
EP-0263605-A2 Wound dressing EDISON POLYMER INNOVATION CORPORATION ( EPIC) (US) 1988-04-13 EP disclosed