SCHEMBL9307035

SCHEMBL9307035

CCCCCCCCCCCCCCOc1ccccc1CN(Cc1ccccn1)C(C)=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
CHRM2 P08172 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADRA2A P08913 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
SLC1A5 Q15758 1/20 0.43
PTPN1 P18031 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL9306473 0.82 HPGD (0.51) ALDH1A1TRPM8HPGDHSD17B10
SCHEMBL9308313 0.79 CYP2D6 (0.47)
SCHEMBL2189143 0.79 TRPM8 (0.47) MAPTLMNAALDH1A1SMN1; SMN2TRPM8
SCHEMBL2187238 0.78 L3MBTL1 (0.55) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
Iodide SCHEMBL9306519 0.77
SCHEMBL6170953 0.74 TRPM8 (0.59) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL8085972 0.74
SCHEMBL9308154 0.74 HSD17B10 (0.52) MAPTLMNAMEN1KMT2AALDH1A1
Acetic Acid SCHEMBL9445256 0.73 MAPT (0.59) MAPTLMNAMEN1NR1I2CHRM2
SCHEMBL9716937 0.72 LMNA (0.66) MAPTLMNAMEN1NR1I2CHRM2

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
US-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 US disclosed
US-5208247-A Antianaphylactic agents or septic shock AMERICAN CYANAMID COMPANY (US) 1993-05-04 US disclosed
EP-0530444-A1 Aryl, amide, imide, and carbamate pyridine antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1993-03-10 EP disclosed