SCHEMBL8092470

SCHEMBL8092470

CCCN(CCC)S(=O)(=O)N(CCc1cccc(OC)c1)C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 5/20 0.49
AKR1C3 P42330 1/20 0.46
BMP1 P13497 1/20 0.45
LPAR1 Q92633 1/20 0.45
LPAR5 Q9H1C0 1/20 0.45
GPR52 Q9Y2T5 1/20 0.45
AOC3 Q16853 1/20 0.44
CTSD P07339 1/20 0.43
BACE1 P56817 1/20 0.43
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43
ABCB1 P08183 1/20 0.43
BCHE P06276 1/20 0.42
LIMK2 P53671 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
SCHEMBL8087753 0.90 TAS2R14 (0.55) TAS2R14LPAR1LPAR5CTSDBACE1
SCHEMBL8092540 0.88 TAS2R14 (0.50) TAS2R14BMP1LPAR1LPAR5PTGES
SCHEMBL8092409 0.86 HSD11B1 (0.47) ABCB1LIMK2
SCHEMBL8087708 0.82 TRPM8 (0.45)
SCHEMBL8079204 0.79 CNR2 (0.47) TAS2R14AKR1C3GPR52
SCHEMBL8079261 0.79 HSD11B1 (0.45) LPAR1LIMK2
SCHEMBL6715335 0.76 PTGES (0.60) AKR1C3LPAR1LPAR5GPR52AOC3
SCHEMBL8090715 0.75 TAS2R14 (0.53) TAS2R14LPAR1GPR52PTGESLIMK2
SCHEMBL8087612 0.75 LPAR1 (0.43) TAS2R14LPAR1LPAR5LIMK2
SCHEMBL8086489 0.75 ALDH1A1 (0.49) BMP1

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