SCHEMBL9633447

SCHEMBL9633447

CNCCC1(c2ccccc2)C(=O)NC(=O)CC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.38
SLC6A2 P23975 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
UTS2R Q9UKP6 1/20 0.34
CYP19A1 P11511 4/20 0.34
TSHR P16473 2/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SLC6A4 P31645 1/20 0.32

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
Dimethylamine SCHEMBL9451435 0.86 CYP19A1 (0.42) BACE1MMP2MMP9CYP19A1TSHR
Dimethylamine SCHEMBL9451428 0.83 TSHR (0.42) BACE1MMP2MMP9CYP19A1TSHR
SCHEMBL9451425 0.81 DRD2 (0.41) BACE1MMP2MMP9UTS2RCYP19A1
SCHEMBL9451432 0.78 BRD4 (0.38) BACE1MMP2MMP9UTS2RCYP19A1
SCHEMBL9303403 0.70 SLC6A2 (0.43) BACE1SLC6A2TSHRMEN1CYP1A2
Dimethylamine SCHEMBL8424457 0.70 SIGMAR1 (0.36) BACE1UTS2RCYP19A1KMT2ASLC6A4
SCHEMBL9666163 0.68 SIGMAR1 (0.35) BACE1SLC6A2UTS2RKMT2ASLC6A4
SCHEMBL5307525 0.67 OPRD1 (0.36) SLC6A2UTS2RMEN1KMT2ASLC6A4
SCHEMBL1568276 0.67 CYP19A1 (0.68) BACE1MMP2MMP9CYP19A1TSHR
SCHEMBL9451487 0.66 UTS2R (0.40) SLC6A2UTS2RCYP19A1KMT2ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0298738-B1 ANTIPSYCHOTIC COMPOSITIONS CONTAINING DIOXOPIPERIDINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 1992-09-30 EP disclosed
EP-0295836-B1 USE OF DIOXOPIPERIDINE DERIVATIVES FOR THE MANUFACTURE OF TOPICAL MEDICAMENTS AS ANALGESICS BTG INTERNATIONAL LIMITED (GB) 1992-09-02 EP disclosed
EP-0368645-B1 MEMORY-ENHANCING COMPOSITIONS CONTAINING DIOXOPIPERIDINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 1992-08-26 EP disclosed
EP-0263594-B1 ANXIOLYTIC COMPOSITIONS CONTAINING DIOXOPIPERIDINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 1992-06-24 EP disclosed