SCHEMBL7797129

SCHEMBL7797129

CCCCCCCCCC(=O)NC(CN1CCCCC1)C(O)c1ccccc1

nearest known ligand 0.98

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 10/20 0.98
MEN1 O00255 2/20 0.80
KMT2A Q03164 2/20 0.80
TP53 P04637 1/20 0.80
CYP3A4 P08684 1/20 0.80
CYP2D6 P10635 1/20 0.80
CYP2C9 P11712 1/20 0.80
NFKB1 P19838 1/20 0.80
MAPK1 P28482 1/20 0.80
CYP2C19 P33261 1/20 0.80
HIF1A Q16665 1/20 0.80
MAPT P10636 1/20 0.80
MTOR P42345 1/20 0.80
GMNN O75496 1/20 0.79
LMNA P02545 1/20 0.79
BLM P54132 1/20 0.79
PMP22 Q01453 1/20 0.79
SMN1; SMN2 Q16637 1/20 0.79
NPSR1 Q6W5P4 1/20 0.79
HTR1A P08908 1/20 0.67

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
SCHEMBL3863329 1.00 UGCG (0.98) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL13567769 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL7677086 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL31275968 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL13398086 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL23845861 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL7101172 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL295611 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL12087892 0.99 UGCG (1.00) UGCGMEN1KMT2ATP53CYP3A4
SCHEMBL13567767 0.98 UGCG (0.98) UGCGMEN1KMT2ATP53CYP3A4

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-0765865-B1 2-ACYLAMINOPROPANOL COMPOUND AND MEDICINAL COMPOSITION SEIKAGAKU KOGYO CO LTD (JP) 2001-12-12 EP disclosed
US-5763438-A ANTIVIRAL AGENTS SEIKAGAKU CORPORATION (JP) 1998-06-09 US disclosed
EP-0765865-A1 2-ACYLAMINOPROPANOL COMPOUND AND MEDICINAL COMPOSITION SEIKAGAKU CORPORATION (JP) 1997-04-02 EP disclosed