SCHEMBL9764134

SCHEMBL9764134

CC1CCCCCC1CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 4/20 0.41
SLC6A11 P48066 4/20 0.41
SLC6A13 Q9NSD5 4/20 0.41
EPHX1 P07099 2/20 0.39
USP2 O75604 1/20 0.39
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
ALDH1A1 P00352 4/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CDC25A P30304 1/20 0.33
AKR1C4 P17516 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A1 P30531 1/20 0.32
GABRA5 P31644 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
SCHEMBL3276937 0.98 SLC6A12 (0.43) SLC6A12SLC6A11SLC6A13EPHX1USP2
SCHEMBL19513333 0.98 SLC6A12 (0.43) SLC6A12SLC6A11SLC6A13EPHX1USP2
SCHEMBL21510225 0.93 SLC6A12 (0.43) SLC6A12SLC6A11SLC6A13EPHX1USP2
SCHEMBL301401 0.93 SLC6A12 (0.43) SLC6A12SLC6A11SLC6A13EPHX1USP2
SCHEMBL4634265 0.85 ANPEP (0.37) SLC6A12SLC6A11SLC6A13EPHX1USP2
SCHEMBL29697589 0.84 SLC6A12 (0.50) SLC6A12SLC6A11SLC6A13EPHX1ALDH1A1
SCHEMBL10489468 0.82 EPHX1 (0.41) EPHX1USP2CA1CA2CA4
SCHEMBL1925986 0.81 SLC6A12 (0.52) SLC6A12SLC6A11SLC6A13ALDH1A1CDC25A
SCHEMBL19193909 0.79 SLC6A12 (0.39) SLC6A12SLC6A11SLC6A13EPHX1USP2
SCHEMBL23748750 0.78 EPHX1 (0.48) EPHX1USP2CA1CA2CA4

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-5003104-A Rhodium compound, an iodide and a lithium component BP CHEMICALS LIMITED (GB) 1991-03-26 US disclosed