Cyclohexylamine

Cyclohexylamine

SCHEMBL8036036

NC1CCCCC1.NCC(N)C(=O)O.O=Cc1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 5/20 0.41
ERN1 O75460 1/20 0.39
MAPT P10636 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 2/20 0.38
KMO O15229 1/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
PTPRA P18433 1/20 0.37

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
Cyclohexylamine SCHEMBL8036033 1.00 GAA (0.43) GAALMNAALDH1A1ERN1MAPT
Cyclohexylamine SCHEMBL7802264 0.88 GAA (0.47) GAALMNAALDH1A1ERN1MAPT
Cyclohexylamine SCHEMBL7792901 0.86 ERN1 (0.48) GAALMNAALDH1A1ERN1MAPT
Cyclohexylamine SCHEMBL8035138 0.84 GRIK1 (0.46) ALDH1A1MAPTSMN1; SMN2KDM4EKMO
Cyclohexylamine SCHEMBL8035135 0.84 GRIK1 (0.46) ALDH1A1MAPTSMN1; SMN2KDM4EKMO
Cyclohexylamine SCHEMBL8035226 0.84 VCAM1 (0.53) GAALMNAALDH1A1MAPTSMN1; SMN2
Cyclohexylamine SCHEMBL8035231 0.84 VCAM1 (0.53) GAALMNAALDH1A1MAPTSMN1; SMN2
3-Nitrobenzaldehyde SCHEMBL8039156 0.83 KMO (0.46) LMNAALDH1A1MAPTSMN1; SMN2KMO
3-Nitrobenzaldehyde SCHEMBL8039154 0.83 KMO (0.46) LMNAALDH1A1MAPTSMN1; SMN2KMO
Lysine SCHEMBL8025632 0.78 GSR (0.46) ERN1MAPTKMOKMT2A

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
US-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 US disclosed