SCHEMBL3407629

SCHEMBL3407629

C#CCNC(=O)CN(c1ccccc1)C1CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.46
TAAR1 Q96RJ0 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
ACHE P22303 1/20 0.36
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL3402515 0.81 OPRM1 (0.44) TAAR1HTTKMT2ALMNAGAA
SCHEMBL3409354 0.77 HDAC1 (0.45) KDM1AHTTKMT2ALMNAGAA
SCHEMBL3404199 0.77 MEN1 (0.49) KDM1AHTTKMT2ALMNAALDH1A1
SCHEMBL2037132 0.75 ALDH1A1 (0.51) TAAR1HTTKMT2ALMNAPOLB
SCHEMBL2346348 0.72 ALDH1A1 (0.47) TAAR1HTTKMT2ALMNAALOX15
SCHEMBL2340823 0.72 ALDH1A1 (0.43) TAAR1HTTKMT2APOLBALDH1A1
SCHEMBL3410307 0.71 KMT2A (0.46) KMT2ALMNAGAAMAPTALDH1A1
SCHEMBL3410387 0.69 LMNA (0.40) HTTKMT2ALMNAGAAPOLB
SCHEMBL9956411 0.69 NPSR1 (0.45) KDM1AHTTKMT2APOLBALOX15
SCHEMBL15272208 0.67 MEN1 (0.55) KDM1AKMT2ALMNAGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2177502-A1 Compounds and their use Oryzon Genomics, S.A. (ES) 2010-04-21 EP claimed
EP-2177502-A1 Compounds and their use Oryzon Genomics, S.A. (ES) 2010-04-21 EP disclosed