SCHEMBL2584582

SCHEMBL2584582

NCCCN(Cc1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LIMK2 P53671 1/20 0.56
MC4R P32245 5/20 0.53
MC3R P41968 5/20 0.53
MC5R P33032 4/20 0.53
ADRA2C P18825 1/20 0.51
REN P00797 1/20 0.51
TDP1 Q9NUW8 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL3795459 0.93 MC4R (0.61) LIMK2MC4RMC3RMC5RREN
SCHEMBL27075772 0.93 MC4R (0.61) LIMK2MC4RMC3RMC5RREN
SCHEMBL1023411 0.89 CARM1 (0.55) LIMK2MC4RMC3RRENTDP1
SCHEMBL3383363 0.87 MAOA (0.57) MC4RMC3RMC5RADRA2C
Hydrochloric Acid SCHEMBL570912 0.87 CARM1 (0.53) LIMK2MC4RMC3RRENTDP1
SCHEMBL21628078 0.86 REN (0.56) MC4RMC3RMC5RRENTDP1
SCHEMBL3382221 0.86 MAOA (0.55) MC4RMC3RMC5RTDP1MEN1
SCHEMBL2076709 0.85 CCR6 (0.59) LIMK2MC4RMC3RMC5RTDP1
SCHEMBL8331046 0.84 CA12 (0.50) LIMK2MC4RMC3RMC5RTDP1
SCHEMBL4207867 0.83 HDAC1 (0.57) RENTDP1MEN1KMT2A

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
EP-2563847-B1 MCR DENDRIMERS LEIBNIZ INST FÜR PFLANZENBIOCHEMIE IPB (DE) 2016-04-13 EP disclosed
EP-2563847-A1 MCR DENDRIMERS Leibniz-Institut für Pflanzenbiochemie (IPB) (DE) 2013-03-06 EP disclosed
WO-2011134607-A1 MCR DENDRIMERS LEIBNIZ-INSTITUT FÜR PFLANZENBIOCHEMIE (DE) 2011-11-03 WO disclosed
US-7214715-B2 Compounds to treat Alzheimer's disease PHARMACIA & UPJOHN (US) 2007-05-08 US disclosed