SCHEMBL7899491

SCHEMBL7899491

CC(C)OP(=O)(OC(C)C)N(CCO)CCO

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.36
ACHE P22303 1/20 0.36
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 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
SCHEMBL6990161 0.71 PPARD (0.46) ACHE
SCHEMBL3340177 0.70 CTSA (0.36) CTSAACHEKDM4EALDH1A1POLB
SCHEMBL11578851 0.68 CTSA (0.31) CTSAACHECHRNB2CHRNB4CHRNA3
Methane SCHEMBL9304185 0.67
SCHEMBL11576047 0.67 PPARD (0.31) CTSAACHE
SCHEMBL10706217 0.65 MAPT (0.35)
SCHEMBL1378198 0.64 CTSA (0.43) CTSAACHEKDM4EALDH1A1POLB
SCHEMBL28131326 0.64 CTSA (0.43) CTSAACHEKDM4EALDH1A1POLB
SCHEMBL9347768 0.64 CA2 (0.37)
SCHEMBL11777503 0.63 MAPT (0.33) KDM4E

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-6190574-B1 OIL ADDITIVE KAO CORPORATION (JP) 2001-02-20 US disclosed