SCHEMBL26417843

SCHEMBL26417843

CCC(C)(C)OCCCNC(=O)NI

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.39
KDM4C Q9H3R0 1/20 0.35
TSHR P16473 2/20 0.35
ACHE P22303 4/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
EPHX2 P34913 1/20 0.33
POLB P06746 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL26363436 0.85 EPHX1 (0.40) EPHX1KDM4CTSHRACHEMAPT
SCHEMBL19821881 0.81 MAPK1 (0.48) EPHX1TSHRACHEHSD17B10
SCHEMBL19822025 0.81 EPHX1 (0.41) EPHX1KDM4CTSHRACHEMAPT
SCHEMBL18867051 0.79 POLB (0.42) EPHX1TSHRACHEMAPTPOLB
SCHEMBL26414872 0.78 EPHX1 (0.37) EPHX1KDM4CTSHRACHEMAPT
SCHEMBL13347430 0.75 MAPK1 (0.42) TSHRACHEHSD17B10
SCHEMBL20215150 0.74 TSHR (0.57) TSHRHSD17B10EPHX2POLBTDP1
SCHEMBL19821976 0.74 EPHX1 (0.35) EPHX1KDM4CEPHX2
SCHEMBL20115916 0.72 EPHX1 (0.35) EPHX1TSHRACHEMAPTHSD17B10
SCHEMBL22560036 0.72

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-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed