SCHEMBL10487372

SCHEMBL10487372

CC(=O)OCC(C)(C)C1CCNCC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
GABRA1 P14867 1/20 0.32
TSHR P16473 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
GABRA4 P48169 1/20 0.32
GABRE P78334 1/20 0.32
PMP22 Q01453 1/20 0.32
GABRA6 Q16445 1/20 0.32
GABRG1 Q8N1C3 1/20 0.32
GABRG3 Q99928 1/20 0.32
GABRQ Q9UN88 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
SCHEMBL10487352 0.77 TDP1 (0.31) LMNA
Acetic Acid SCHEMBL10487370 0.74 GABRA5 (0.39) ARG1ARG2GABRPGABRDGABRA1
SCHEMBL26412055 0.72 GAA (0.38) ARG1ARG2GABRPGABRDGABRA1
SCHEMBL3624797 0.70 SLC6A1 (0.41) GABRA1TSHRGABRA5GABRB2GABRA4
SCHEMBL2674989 0.70 LMNA (0.35) ARG1ARG2GABRPGABRDGABRA1
SCHEMBL7420286 0.69 CHRM2 (0.42) GABRPGABRDGABRA1TSHRGABRB1
SCHEMBL19033715 0.69 MEN1 (0.33) ARG1ARG2LMNA
Hydrochloric Acid SCHEMBL5259892 0.69 SLC6A1 (0.40) GABRA1TSHRGABRA5GABRB2GABRA4
SCHEMBL23826437 0.69 GABRA5 (0.34) ARG1ARG2GABRPGABRDGABRA1
SCHEMBL12928717 0.69 GABRA5 (0.39) ARG1ARG2GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4871748-A RODENTICIDES MAY & BAKER LIMITED (GB) 1989-10-03 US disclosed