SCHEMBL10503567

SCHEMBL10503567

CN1CCN(C2CC(=O)N(Cc3ccccc3)C2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.54
TSHR P16473 1/20 0.54
MC4R P32245 1/20 0.47
TACR1 P25103 1/20 0.47
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
DPP4 P27487 2/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TP53 P04637 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL9461919 0.78 MC4R (0.53) HPGDTSHRMC4RPDE4APDE4B
SCHEMBL8188156 0.76 MC4R (0.66) MC4RTACR1TP53SMN1; SMN2NPC1
SCHEMBL18187683 0.75 MGLL (0.64)
SCHEMBL16080214 0.74 HPGD (0.64) HPGDTSHRPDE4APDE4BPDE4C
SCHEMBL434087 0.74 HPGD (0.64) HPGDTSHRPDE4APDE4BPDE4C
SCHEMBL9633705 0.74 MC4R (0.46) HPGDTSHRMC4RTACR1MAPT
SCHEMBL13443303 0.72 MC4R (0.60) TSHRMC4RMAPTSMN1; SMN2ALDH1A1
SCHEMBL3956954 0.72 MC4R (0.69) TSHRMC4RMAPTKDM4ESMN1; SMN2
SCHEMBL13036597 0.72 HPGD (0.60) HPGDTSHRPDE4APDE4BPDE4C
SCHEMBL4922166 0.71 HPGD (0.64) HPGDTSHRPDE4APDE4BPDE4C

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-0136658-B1 -1-BENZYL-AMINOALKYL-PYRROLIDINONES AND THEIR ADDITION SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOUNDS CONTAINING THEM BOEHRINGER INGELHEIM KG (DE) 1989-04-26 EP disclosed
EP-0136658-A2 -1-Benzyl-aminoalkyl-pyrrolidinones and their addition salts, process for their preparation and pharmaceutical compounds containing them BOEHRINGER INGELHEIM KG (DE) 1985-04-10 EP disclosed