Cyclohexylamine

Cyclohexylamine

SCHEMBL7792801

CC(=O)Nc1ccc(C=O)cc1.NC1CCCCC1.NCC[C@H](N)C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
LMNA P02545 2/20 0.39
KMT2A Q03164 1/20 0.39
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
LTA4H P09960 1/20 0.36
NAMPT P43490 1/20 0.36

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 SCHEMBL7792803 1.00 DHODH (0.41) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Cyclohexylamine SCHEMBL7802533 0.99 DHODH (0.40) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Cyclohexylamine SCHEMBL7798160 0.97 DHODH (0.39) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Ornithine SCHEMBL7793059 0.94 DPP8 (0.42) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Ornithine Aketoglutarate SCHEMBL7793056 0.94 DPP8 (0.42) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Lysine SCHEMBL7798555 0.93 DPP8 (0.46) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Lysine SCHEMBL7792537 0.93 DPP8 (0.46) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Ornithine SCHEMBL7798084 0.93 DPP8 (0.42) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Lysine SCHEMBL8041332 0.93 DPP8 (0.46) DHODHKDM4EALDH1A1SMN1; SMN2HTT
Lysine SCHEMBL7798559 0.93 DPP8 (0.46) DHODHKDM4EALDH1A1SMN1; SMN2HTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1076649-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 2001-02-21 EP disclosed
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
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 WO disclosed