SCHEMBL4644441

SCHEMBL4644441

CCOc1ccc(OC(=O)CCl)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
KDM4E B2RXH2 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NQO1 P15559 1/20 0.54
PARP10 Q53GL7 1/20 0.52
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.50
NPC1 O15118 2/20 0.49
LMNA P02545 2/20 0.49
RAB9A P51151 1/20 0.49
PLK1 P53350 1/20 0.49
POLB P06746 1/20 0.49
CYP1A2 P05177 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
PLA2G4B P0C869 1/20 0.46

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
SCHEMBL4095285 0.85 KMT2A (0.52) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL4643454 0.85 KMT2A (0.55) ALDH1A1KDM4ESMN1; SMN2NQO1PARP10
SCHEMBL27619963 0.85 TOP2A (0.44) ALDH1A1KDM4ESMN1; SMN2NQO1PARP10
SCHEMBL4644529 0.84 KMT2A (0.54) ALDH1A1KDM4ESMN1; SMN2NQO1PARP10
SCHEMBL4642336 0.82 NQO1 (0.56) ALDH1A1SMN1; SMN2NQO1PARP10KMT2A
SCHEMBL4644350 0.82 KMT2A (0.52) ALDH1A1KDM4ESMN1; SMN2NQO1PARP10
SCHEMBL20703605 0.81 BCL9 (0.60) ALDH1A1NQO1PARP10KMT2AMEN1
SCHEMBL4645067 0.81 NQO1 (0.54) ALDH1A1SMN1; SMN2NQO1PARP10KMT2A
SCHEMBL10390223 0.81 RAB9A (0.50) ALDH1A1KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL10500407 0.80 LMNA (0.57) ALDH1A1SMN1; SMN2KMT2AMEN1NPC1

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 5 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
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed