SCHEMBL8092409

SCHEMBL8092409

CCCN(CCC)S(=O)(=O)N(CCc1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.47
RCE1 Q9Y256 1/20 0.46
CA12 O43570 4/20 0.44
CA9 Q16790 4/20 0.44
LIMK1 P53667 2/20 0.43
MLYCD O95822 2/20 0.42
CA2 P00918 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
ABCC2 Q92887 1/20 0.41
SLC22A12 Q96S37 1/20 0.41
UGT1A7 Q9HAW7 1/20 0.41
SLC22A11 Q9NSA0 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
LIMK2 P53671 1/20 0.41
CA1 P00915 2/20 0.40
OPRM1 P35372 2/20 0.40

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
SCHEMBL8079204 0.92 CNR2 (0.47) HSD11B1RCE1CA12CA9RAB9A
SCHEMBL8079261 0.92 HSD11B1 (0.45) HSD11B1RCE1CA12CA9LIMK1
SCHEMBL8092540 0.89 TAS2R14 (0.50) RAB9A
SCHEMBL8086489 0.87 ALDH1A1 (0.49) CA12CA9CA2RAB9ASMN1; SMN2
SCHEMBL8092470 0.86 TAS2R14 (0.49) LIMK2ABCB1
SCHEMBL8087708 0.85 TRPM8 (0.45) MLYCDRAB9ASMN1; SMN2OPRM1DRD3
SCHEMBL8090675 0.84 TAAR1 (0.43) HSD11B1CA12CA9CA2RAB9A
SCHEMBL8087752 0.83 CES2 (0.43) HSD11B1CA12CA9CA2RAB9A
SCHEMBL8087638 0.80 TAS2R14 (0.50) HSD11B1LIMK1RAB9ASMN1; SMN2HDAC1
SCHEMBL8090715 0.80 TAS2R14 (0.53) HSD11B1CA12CA9LIMK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1047670-A1 AMINOSULPHONYLBENZAMIDE DERIVATIVES AS MODULATORS OF THE ACTIVITY OF NEURONAL CALCIUM CHANNELS ELI LILLY AND COMPANY LIMITED (GB) 2000-11-02 EP disclosed
WO-1999036398-A1 AMINOSULPHONYLBENZAMIDE DERIVATIVES AS MODULATORS OF THE ACTIVITY OF NEURONAL CALCIUM CHANNELS ELI LILLY AND COMPANY LIMITED (GB) 1999-07-22 WO disclosed