SCHEMBL8564803

SCHEMBL8564803

C[C@H](c1ccccc1)N1CC[C@H](CC(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HTT P42858 1/20 0.51
MAPT P10636 2/20 0.50
ALDH1A1 P00352 2/20 0.50
DUSP3 P51452 1/20 0.50
PTPN5 P54829 1/20 0.50
PTPN11 Q06124 1/20 0.50
CYP2D6 P10635 1/20 0.49
KDM4E B2RXH2 1/20 0.48
CHRM4 P08173 2/20 0.45
DRD4 P21917 1/20 0.44
MC4R P32245 1/20 0.44
SLC6A9 P48067 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42
OPRL1 P41146 1/20 0.42
LTA4H P09960 1/20 0.42
HSP90AA1 P07900 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
SCHEMBL8566029 1.00 LMNA (0.52) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL4673678 1.00 LMNA (0.52) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL844128 1.00 LMNA (0.52) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL844722 0.87 LMNA (0.51) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL6631278 0.87 LMNA (0.51) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL4533970 0.84 SMN1; SMN2 (0.49) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL7291562 0.84 LMNA (0.55) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL7459001 0.84 LMNA (0.55) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL5453145 0.84 LMNA (0.55) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1713427 0.84 LMNA (0.55) LMNASMN1; SMN2HTTMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0559752-B1 OPTICAL ISOMERS OF 7- 3-(1,1-DIALKYLMETHYL-1-AMINO-1-PYRROLIDINYL]-QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 1998-01-28 EP disclosed
US-5364861-A Bactericides with side effect reduction WARNER-LAMBERT COMPANY (US) 1994-11-15 US disclosed
US-5278317-A Aminomethylpyrrole WARNER-LAMBERT COMPANY (US) 1994-01-11 US disclosed
EP-0559752-A1 OPTICAL ISOMERS OF 7- 3-(1,1-DIALKYLMETHYL-1-AMINO-1-PYRROLIDINYL]-QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1993-09-15 EP disclosed
US-5157128-A Antibacterial agents WARNER-LAMBERT COMPANY (US) 1992-10-20 US disclosed
WO-1992009597-A1 OPTICAL ISOMERS OF 7-[3-(1,1-DIALKYLMETHYL-1-AMINO-1-PYRROLIDINYL]-QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1992-06-11 WO disclosed
US-5072001-A Bactericides WARNER-LAMBERT COMPANY (US) 1991-12-10 US disclosed