SCHEMBL9504417

SCHEMBL9504417

CC(N)C1CCCC(C(=O)O)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.46
BTK Q06187 1/20 0.42
TSHR P16473 2/20 0.38
EPHX2 P34913 1/20 0.37
SLC1A2 P43004 3/20 0.37
SLC1A1 P43005 2/20 0.37
GABRR1 P24046 1/20 0.37
LMNA P02545 2/20 0.34
SLC6A1 P30531 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
GRM8 O00222 1/20 0.34
GRM6 O15303 1/20 0.34
APEX1 P27695 1/20 0.34
GRM5 P41594 1/20 0.34
PMP22 Q01453 1/20 0.34
GRM1 Q13255 1/20 0.34
GRM2 Q14416 1/20 0.34
GRM3 Q14832 1/20 0.34
GRM4 Q14833 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
SCHEMBL9504406 1.00 ANPEP (0.46) ANPEPBTKTSHREPHX2SLC1A2
SCHEMBL9505565 1.00 ANPEP (0.46) ANPEPBTKTSHREPHX2SLC1A2
SCHEMBL9294286 0.88 ROCK2 (0.41) ANPEPTSHRSLC1A2SLC1A1GABRR1
SCHEMBL9415845 0.85 ANPEP (0.47) ANPEPBTKTSHREPHX2SLC1A2
SCHEMBL9415843 0.85 ANPEP (0.47) ANPEPBTKTSHREPHX2SLC1A2
SCHEMBL9415840 0.85 ANPEP (0.47) ANPEPBTKTSHREPHX2SLC1A2
SCHEMBL824192 0.84 BTK (0.45) ANPEPBTKTSHREPHX2GABRR1
SCHEMBL14447179 0.84 BTK (0.45) ANPEPBTKTSHREPHX2GABRR1
SCHEMBL19604526 0.84 BTK (0.45) ANPEPBTKTSHREPHX2GABRR1
SCHEMBL12926820 0.81 BTK (0.42) ANPEPBTKTSHREPHX2SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0329105-B1 MOLECULAR WEIGHT CONTROLLER FOR POLYMERIZATION OF LACTAMS TO POLYAMIDES BASF Corporation (US) 1993-07-07 EP claimed
US-5006635-A Monofunctional amine, monofunctional acid, salt of aminoacid, polyamides BASF CORPORATION (US) 1991-04-09 US claimed
EP-0329105-A2 Molecular weight controller for polymerization of lactams to polyamides BASF Corporation (US) 1989-08-23 EP claimed
US-4844834-A Molecular weight controller for polymerization of lactams to polyamides BASF CORPORATION (US) 1989-07-04 US claimed
EP-0329105-B1 MOLECULAR WEIGHT CONTROLLER FOR POLYMERIZATION OF LACTAMS TO POLYAMIDES BASF Corporation (US) 1993-07-07 EP disclosed
US-5006635-A Monofunctional amine, monofunctional acid, salt of aminoacid, polyamides BASF CORPORATION (US) 1991-04-09 US disclosed
EP-0329105-A2 Molecular weight controller for polymerization of lactams to polyamides BASF Corporation (US) 1989-08-23 EP disclosed
US-4844834-A Molecular weight controller for polymerization of lactams to polyamides BASF CORPORATION (US) 1989-07-04 US disclosed