SCHEMBL8973840

SCHEMBL8973840

C=C(C)C(=O)OC1CCCCC1.CC1CCCN(C)C1(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL440149 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL439354 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL18823066 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL887989 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL18822970 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL22480 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL16297135 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL1052594 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL28878275 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19
SCHEMBL2201867 0.78 EPHX1 (0.46) EPHX1SMN1; SMN2CYP2C19

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-5534579-A PAINTS, ACRYLIC MONOMER CONTAINING PIPERIDINE GROUP, CARBOXYLIC ACID CONTAINING EMULSIFIER, REACTION BETWEEN EMULSIFIER AND EMULSION POLYMER NIPPON SHOKUBAI CO., LTD. (JP) 1996-07-09 US disclosed