SCHEMBL27619985

SCHEMBL27619985

O=C(Cl)CCCC(=O)C(=O)C(Cl)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 5/20 0.36
CES1 P23141 5/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2D6 P10635 1/20 0.34
SRC P12931 1/20 0.34
LMNA P02545 3/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL4641491 0.85 MEN1 (0.39) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL4645376 0.85 SMN1; SMN2 (0.39) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL4642378 0.83 MEN1 (0.38) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL4646119 0.83 SMN1; SMN2 (0.38) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL27620008 0.82 CES2 (0.57) CES2CES1CYP2D6SRCLMNA
SCHEMBL4645492 0.81 MEN1 (0.41) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL4644194 0.81 LMNA (0.41) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL4647061 0.77 CES2 (0.42) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL4643592 0.77 ALDH1A1 (0.42) CES2CES1MEN1KMT2ACYP2D6
SCHEMBL5050305 0.72 CES2 (0.48) CES2CES1MEN1KMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed