SCHEMBL9504387

SCHEMBL9504387

CC(C)(N)C1CCC(C(=O)O)C1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.42
GABRR1 P24046 5/20 0.39
LMNA P02545 2/20 0.38
PLG P00747 1/20 0.38
PLAT P00750 1/20 0.38
BTK Q06187 1/20 0.38
ACE P12821 1/20 0.37
AKR1C3 P42330 1/20 0.36
AKR1C1 Q04828 1/20 0.36
GRM3 Q14832 1/20 0.35
GABRR2 P28476 1/20 0.34
GLA P06280 1/20 0.34
RAB9A P51151 1/20 0.33
GRM1 Q13255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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 SCHEMBL2941903 0.85 LMNA (0.43) GRM2LMNAPLGPLATBTK
SCHEMBL1073419 0.83 GLA (0.43) GRM2GABRR1LMNAPLGPLAT
SCHEMBL18628984 0.76 GRM2 (0.37) GRM2GABRR1LMNAPLGPLAT
SCHEMBL28493088 0.74 ACE (0.39) GABRR1LMNAPLGPLATBTK
SCHEMBL27561618 0.74 SMN1; SMN2 (0.41) GLARAB9AALDH1A1TDP1
SCHEMBL17893133 0.73 BTK (0.41) GRM2GABRR1LMNABTKACE
SCHEMBL1835961 0.73 GLA (0.50) LMNAPLGPLATGLARAB9A
SCHEMBL2675870 0.73 LMNA (0.48) LMNAPLGPLATBTKACE
SCHEMBL3514603 0.73 GLA (0.50) LMNAPLGPLATGLARAB9A
SCHEMBL503482 0.73 GLA (0.50) LMNAPLGPLATGLARAB9A

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-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