Cyclohexane

Cyclohexane

SCHEMBL3971471

C1CCCCC1.O=C(O)NC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.65
LMNA P02545 1/20 0.65
ALB P02768 1/20 0.65
KMT2A Q03164 1/20 0.65
CCKBR P32239 11/20 0.63
CCKAR P32238 4/20 0.62
CHRM1 P11229 1/20 0.58
CNR1 P21554 1/20 0.52
NTSR1 P30989 1/20 0.52
OPRK1 P41145 1/20 0.52
PDE4D Q08499 1/20 0.52

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
SCHEMBL4819173 0.97 MEN1 (0.69) MEN1LMNAALBKMT2ACCKBR
Cyclohexane SCHEMBL3964908 0.91 CCKBR (0.62) MEN1LMNAALBKMT2ACCKBR
SCHEMBL643212 0.88 MEN1 (0.58) MEN1LMNAALBKMT2ACCKBR
SCHEMBL641962 0.88 MEN1 (0.66) MEN1LMNAALBKMT2ACCKBR
Cyclohexane SCHEMBL3966556 0.86 CCKBR (0.71) CCKBRCCKAR
SCHEMBL4701636 0.86 LMNA (0.68) MEN1LMNAALBKMT2ACCKBR
SCHEMBL3969425 0.85 MEN1 (0.55) MEN1LMNAALBKMT2ACCKBR
SCHEMBL5418531 0.85 LMNA (0.72) MEN1LMNAALBKMT2ACCKBR
SCHEMBL643974 0.85 CHRM1 (0.65) MEN1LMNAALBKMT2ACCKBR
SCHEMBL11899990 0.84 CCKBR (0.78) CCKBRCCKAR

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-1727550-B1 PHARMACEUTICAL COMPOSITION COMPRISING A BENZODIAZEPINE DERIVATIVE AND AN INHIBITOR OF THE RSV FUSION PROTEIN ARROW THERAPEUTICS LTD (GB) 2009-07-29 EP claimed