SCHEMBL7103066

SCHEMBL7103066

Fc1ccc(C(c2cccnc2)N2CCNCC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
SLC1A3 P43003 1/20 0.52
SLC1A2 P43004 1/20 0.52
SLC1A1 P43005 1/20 0.52
P4HB P07237 1/20 0.49
OPRD1 P41143 7/20 0.49
OPRM1 P35372 1/20 0.49
OPRK1 P41145 1/20 0.49
OPRL1 P41146 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP19A1 P11511 1/20 0.49
CYP3A4 P08684 5/20 0.48
CYP3A5 P20815 5/20 0.48
SLC6A2 P23975 2/20 0.48
SLC6A4 P31645 2/20 0.48
SLC6A3 Q01959 1/20 0.48
KCNA5 P22460 1/20 0.48
KCNH2 Q12809 1/20 0.48

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
SCHEMBL15093686 0.90 MEN1 (0.62) MEN1KMT2ASLC1A3SLC1A2SLC1A1
SCHEMBL9251253 0.88 MEN1 (0.72) MEN1KMT2ASLC1A3SLC1A2SLC1A1
SCHEMBL11193886 0.84 CYP2D6 (0.56) MEN1KMT2AP4HBOPRD1CYP2D6
SCHEMBL1138320 0.84 MEN1 (0.79) MEN1KMT2AOPRD1OPRM1OPRK1
SCHEMBL16225886 0.84 MEN1 (0.79) MEN1KMT2AOPRD1OPRM1OPRK1
SCHEMBL1138318 0.84 MEN1 (0.79) MEN1KMT2AOPRD1OPRM1OPRK1
SCHEMBL336219 0.83 CYP2D6 (0.67) MEN1KMT2AP4HBOPRD1OPRM1
SCHEMBL31023820 0.83 OPRD1 (0.52) MEN1KMT2ASLC1A3SLC1A2SLC1A1
SCHEMBL16226307 0.78 OPRD1 (0.63) MEN1KMT2AOPRD1OPRM1OPRK1
Nitric Acid SCHEMBL11199010 0.78 CYP3A4 (0.60) MEN1KMT2ASLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020443-B1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF AZWELL INC (JP) 2003-09-10 EP disclosed
US-6172228-B1 Process for producing piperazinesulfonamide derivatives and salts thereof AZWELL INC. (JP) 2001-01-09 US disclosed
EP-1020443-A1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF Azwell Inc. (JP) 2000-07-19 EP disclosed