Cyclohexylamine

Cyclohexylamine

SCHEMBL8025596

NC1CCCCC1.NC[C@H](N)C(=O)O.O=Cc1c(F)cccc1Cl

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
PBRM1 Q86U86 2/20 0.34
EPHX1 P07099 1/20 0.34
PYGL P06737 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
ALOX12 P18054 1/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KIF11 P52732 1/20 0.34
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33

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 SCHEMBL8025597 1.00 GRIK1 (0.39) GRIK1GRIK2RAB9ANPC1PBRM1
Lysine SCHEMBL8025637 0.90 GSR (0.40) GRIK1GRIK2TDP1
Lysine SCHEMBL8025635 0.90 GSR (0.40) GRIK1GRIK2TDP1
Cyclohexylamine SCHEMBL7798411 0.88 RAB9A (0.38) RAB9ANPC1PBRM1TDP1MEN1
Cyclohexylamine SCHEMBL7798273 0.85 KMT2A (0.47) RAB9ANPC1PBRM1TDP1MEN1
Cyclohexylamine SCHEMBL8036007 0.82 NPC1 (0.40) GRIK1RAB9ANPC1EPHX1MEN1
Cyclohexylamine SCHEMBL8036004 0.82 NPC1 (0.40) GRIK1RAB9ANPC1EPHX1MEN1
Cyclohexylamine SCHEMBL8041276 0.79 EPHX2 (0.33) GRIK1GRIK2KIF11
Cyclohexylamine SCHEMBL8041254 0.79 TP53 (0.41) RAB9ANPC1MEN1KMT2AATM
Cyclohexylamine SCHEMBL8041252 0.79 TP53 (0.41) RAB9ANPC1MEN1KMT2AATM

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