Cyclohexylamine

Cyclohexylamine

SCHEMBL8036004

NC1CCCCC1.NC[C@H](N)C(=O)O.O=Cc1ccccc1F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KIF11 P52732 2/20 0.39
C3AR1 Q16581 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
EPHX1 P07099 1/20 0.34
GAA P10253 1/20 0.34
SLC1A5 Q15758 1/20 0.34
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ERN1 O75460 1/20 0.33
ALPI P09923 1/20 0.33
PKM P14618 1/20 0.33
PTGS1 P23219 1/20 0.33
XIAP P98170 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 SCHEMBL8036007 1.00 NPC1 (0.40) NPC1MAPTRAB9ASMN1; SMN2KIF11
Lysine SCHEMBL8035193 0.89 GSR (0.43) NPC1MAPTRAB9ASMN1; SMN2KIF11
Lysine SCHEMBL8035194 0.89 GSR (0.43) NPC1MAPTRAB9ASMN1; SMN2KIF11
Cyclohexylamine SCHEMBL7801529 0.86 NPC1 (0.44) NPC1MAPTRAB9ASMN1; SMN2C3AR1
Cyclohexylamine SCHEMBL8035749 0.86 KIF11 (0.39) MAPTKIF11HPGDPPARGPPARA
Cyclohexylamine SCHEMBL8035751 0.86 KIF11 (0.39) MAPTKIF11HPGDPPARGPPARA
Cyclohexylamine SCHEMBL8041278 0.85 EPHX2 (0.33) KIF11PPARGPPARAGRIK1
Cyclohexylamine SCHEMBL8041276 0.85 EPHX2 (0.33) KIF11PPARGPPARAGRIK1
Cyclohexylamine SCHEMBL8039051 0.84 GRIK1 (0.46) KIF11ALDH1A1HPGDEPHX1PPARG
Cyclohexylamine SCHEMBL8039053 0.84 GRIK1 (0.46) KIF11ALDH1A1HPGDEPHX1PPARG

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