Cyclohexylamine

Cyclohexylamine

SCHEMBL8035772

NC1CCCCC1.NC[C@H](N)C(=O)O.O=Cc1ccc(Br)o1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CTDSP1 Q9GZU7 1/20 0.35
ALDH1A1 P00352 3/20 0.34
TSHR P16473 1/20 0.34
KIF11 P52732 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
GRIK1 P39086 1/20 0.33
LMNA P02545 3/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 2/20 0.32
GAA P10253 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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 SCHEMBL8035776 1.00 TDP1 (0.38) TDP1L3MBTL1CTDSP1ALDH1A1TSHR
Lysine SCHEMBL8039058 0.88 GSR (0.42) TDP1L3MBTL1CTDSP1ALDH1A1TSHR
Lysine SCHEMBL8039060 0.88 GSR (0.42) TDP1L3MBTL1CTDSP1ALDH1A1TSHR
Cyclohexylamine SCHEMBL7798067 0.87 L3MBTL1 (0.41) TDP1L3MBTL1CTDSP1ALDH1A1TSHR
Aes-103 SCHEMBL8025663 0.85 ALDH1A1 (0.50) TDP1ALDH1A1TSHRKIF11GRIK1
Aes-103 SCHEMBL8025669 0.85 ALDH1A1 (0.50) TDP1ALDH1A1TSHRKIF11GRIK1
Cyclohexylamine SCHEMBL7802602 0.83 TDP1 (0.40) TDP1L3MBTL1CTDSP1ALDH1A1TSHR
Cyclohexylamine SCHEMBL8025516 0.82 CASP6 (0.44) TDP1L3MBTL1ALDH1A1SMN1; SMN2LMNA
Cyclohexylamine SCHEMBL8025520 0.82 CASP6 (0.44) TDP1L3MBTL1ALDH1A1SMN1; SMN2LMNA
Cyclohexylamine SCHEMBL8039236 0.80 ALDH1A1 (0.43) TDP1L3MBTL1ALDH1A1TSHRKIF11

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