SCHEMBL8631446

SCHEMBL8631446

NCCCNCCCCCCCCNCCCNCc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.78
MAOA P21397 1/20 0.74
SIGMAR1 Q99720 5/20 0.65
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
MC4R P32245 1/20 0.56
MC5R P33032 1/20 0.56
MC3R P41968 1/20 0.56
MAOB P27338 1/20 0.54

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
Hydrochloric Acid SCHEMBL8645237 0.98 CHRM2 (0.75) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL10938227 0.96 CHRM2 (0.77) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL16151775 0.96 CHRM2 (0.70) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL9192642 0.96 CHRM2 (0.70) CHRM2MAOASIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL29778302 0.94 CHRM2 (0.68) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL2761312 0.94 CHRM2 (0.74) CHRM2MAOASIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL29778293 0.94 CHRM2 (0.68) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL8643581 0.94 CHRM2 (0.81) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL12523230 0.94 CHRM2 (0.68) CHRM2MAOASIGMAR1MEN1KMT2A
SCHEMBL21799882 0.92 MAOA (0.80) CHRM2MAOASIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719193-A Method of potentiating cell-mediated immunity utilizing polyamine derivatives MERRELL PHARMACEUTICALS, INC. (US) 1998-02-17 US claimed
US-5753714-A ANTIPROTOZOA AGENTS MERRELL PHARMACEUTICALS INC. (US) 1998-05-19 US disclosed
US-5719193-A Method of potentiating cell-mediated immunity utilizing polyamine derivatives MERRELL PHARMACEUTICALS, INC. (US) 1998-02-17 US disclosed
EP-0277635-A2 Novel polyamine derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1988-08-10 EP disclosed