SCHEMBL8038153

SCHEMBL8038153

CC1CN(C(=O)O)CCN(C(=O)O)CCN(C(=O)O)CCN1C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.48
CNR1 P21554 4/20 0.34
CNR2 P34972 2/20 0.34
GSK3B P49841 2/20 0.33
DYRK1A Q13627 2/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
P2RX7 Q99572 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 2/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL2379763 0.98 CHRM1 (0.49) CHRM1CNR1CNR2GSK3BDYRK1A
SCHEMBL2901294 0.98 CHRM1 (0.49) CHRM1CNR1CNR2GSK3BDYRK1A
SCHEMBL2908533 0.98 CHRM1 (0.49) CHRM1CNR1CNR2GSK3BDYRK1A
Hydrochloric Acid SCHEMBL28915471 0.96 CHRM1 (0.48) CHRM1CNR1CNR2GSK3BDYRK1A
Hydrochloric Acid SCHEMBL28577066 0.96 CHRM1 (0.48) CHRM1CNR1CNR2GSK3BDYRK1A
Hydrochloric Acid SCHEMBL28577068 0.96 CHRM1 (0.48) CHRM1CNR1CNR2GSK3BDYRK1A
SCHEMBL20434091 0.81 CYP1A2 (0.48) CHRM1GSK3BDYRK1ACYP1A2TDP1
SCHEMBL15431899 0.81 CYP1A2 (0.48) CHRM1GSK3BDYRK1ACYP1A2TDP1
SCHEMBL17625631 0.81 CYP1A2 (0.48) CHRM1GSK3BDYRK1ACYP1A2TDP1
SCHEMBL7995036 0.79 TSHR (0.41) LMNAALOX15TSHRHSD17B10HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0232751-B1 1-SUBSTITUTED-4,7,10-TRISCARBOXYMETHYL-1,4,7,10-TETRAAZACYCLODODECANE AND ANALOGS E.R. Squibb & Sons, Inc. (US) 1991-09-11 EP claimed
US-4885363-A RADIOPHARMACEUTICAL IMAGING; MEDICAL DIAGNOSIS E. R. SQUIBB & SONS, INC. (US) 1989-12-05 US claimed
EP-0292689-A2 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INTERNATIONAL B.V. (NL) 1988-11-30 EP claimed
EP-0232751-A1 1-substituted-4,7,10-triscarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs E.R. Squibb & Sons, Inc. (US) 1987-08-19 EP claimed
US-6143274-A IMAGING MAMMALIAN TISSUE UTILIZING A NON-IONIC COMPLEX OF A PARAMAGNETIC ION OF LANTHANIDE ELEMENT AND A MACROCYCLIC CHELATING AGENT BRACCO DIAGNOSTICS, INC. 2000-11-07 US disclosed
US-5846519-A Method for imaging mammalian tissue using 1-substituted-1,4,7-tricarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs BRACCO DIAGNOSTICS INC. (US) 1998-12-08 US disclosed
US-5674470-A Method for imaging mammalian tissue using 1-substituted- 4,7,10-tricarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs BRACCO DIAGNOSTICS INC. (US) 1997-10-07 US disclosed
EP-0292689-B1 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INT BV (NL) 1996-07-31 EP disclosed
US-5474756-A Chelate compound of a paramagnetic ion of lanthanide element BRACCO INTERNATIONAL B.V. (NL) 1995-12-12 US disclosed
EP-0394394-B1 MANGANESE(II) CHELATES NYCOMED SALUTAR INC (US) 1995-01-18 EP disclosed
US-5155224-A Protonated, insoluble magnetic resonance imaging contrast agents SALUTAR, INC. (US) 1992-10-13 US disclosed
EP-0232751-B1 1-SUBSTITUTED-4,7,10-TRISCARBOXYMETHYL-1,4,7,10-TETRAAZACYCLODODECANE AND ANALOGS E.R. Squibb & Sons, Inc. (US) 1991-09-11 EP disclosed
US-4978763-A Novel manganese(II) DTPA chelate SALUTAR, INC. (US) 1990-12-18 US disclosed
EP-0394394-A1 MANGANESE(II) CHELATES. SALUTAR INC (US) 1990-10-31 EP disclosed
EP-0369497-A1 Manganese (II) chelates SALUTAR, INC. (US) 1990-05-23 EP disclosed
WO-1990003975-A1 MANGANESE(II) CHELATES SALUTAR, INC. (US) 1990-04-19 WO disclosed
US-4889931-A TREATING MANGANESE OXIDE WITH CHELATING AGENTS SALUTAR, INC. (US) 1989-12-26 US disclosed
US-4885363-A RADIOPHARMACEUTICAL IMAGING; MEDICAL DIAGNOSIS E. R. SQUIBB & SONS, INC. (US) 1989-12-05 US disclosed
EP-0292689-A2 Substituted 1,4,7-triscarboxymethyl-1,4,7,10-tetraazacyclo-dodecane and analogs BRACCO INTERNATIONAL B.V. (NL) 1988-11-30 EP disclosed
EP-0232751-A1 1-substituted-4,7,10-triscarboxymethyl-1,4,7,10-tetraazacyclododecane and analogs E.R. Squibb & Sons, Inc. (US) 1987-08-19 EP disclosed