SCHEMBL1148735

SCHEMBL1148735

CCCCCCCCCCCCCCCCCCOC1CCCCC1=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
RECQL P46063 2/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
EPHX2 P34913 1/20 0.37
BLM P54132 1/20 0.37
GBA1 P04062 1/20 0.37
KMT2A Q03164 3/20 0.36
CYP1A2 P05177 2/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NAAA Q02083 1/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL9419269 1.00 CA1 (0.37) CA1CA2CA4RECQLGLA
SCHEMBL898915 0.93 RECQL (0.35) RECQLGLAHPGDTSHRMAPK1
SCHEMBL11669744 0.93 POLB (0.40) CA1CA2CA4KMT2APOLB
SCHEMBL28074353 0.89 ALDH1A1 (0.33) RECQLGLAHPGDTSHRMAPK1
SCHEMBL12894260 0.88 CYP19A1 (0.37) CA1CA2KMT2APOLBNPC1
SCHEMBL10215418 0.86 CA1 (0.42) CA1CA2CA4KMT2APOLB
SCHEMBL12590724 0.80 CYP19A1 (0.39) CA1CA2KMT2ACYP1A2POLB
SCHEMBL930707 0.78 CA1 (0.45) CA1CA2CA4KMT2APOLB
SCHEMBL9363608 0.77 CA1 (0.41) CA1CA2CA4MAPK1KMT2A
SCHEMBL9872329 0.76 GBA1 (0.34) CA1CA2RECQLGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034637-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2011-02-10 US disclosed
US-20110034637-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2011-02-10 US disclosed
EP-2229418-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP Assets B.V. (NL) 2010-09-22 EP disclosed
WO-2009087107-A1 COMPOSITION WITH A POLYMER AND AN OXIDATION-CATALYST DSM IP ASSETS B.V. (NL) 2009-07-16 WO disclosed