SCHEMBL1902203

SCHEMBL1902203

CCCCCCCCOOC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.47
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 1/20 0.39
MEN1 O00255 1/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.36
SIGMAR1 Q99720 2/20 0.35
RECQL P46063 2/20 0.34
EPHX2 P34913 2/20 0.34
CES2 O00748 1/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
BLM P54132 1/20 0.34
GBA1 P04062 1/20 0.34
EPHX1 P07099 4/20 0.34

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
SCHEMBL29039982 1.00 NAAA (0.47) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL9306313 1.00 NAAA (0.47) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL27708576 1.00 NAAA (0.47) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL23532386 0.98 NAAA (0.44) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL9266890 0.98 NAAA (0.46) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL1324505 0.92 NAAA (0.42) NAAAALDH1A1TDP1CYP1A2HTT
SCHEMBL27864165 0.81
SCHEMBL1898488 0.79 NAAA (0.50) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL732227 0.79 NAAA (0.50) NAAAALDH1A1TDP1CYP1A2MEN1
SCHEMBL8743876 0.79 NAAA (0.50) NAAAALDH1A1TDP1CYP1A2MEN1

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
EP-1960477-B1 NOVEL YELLOW PIGMENTS AND NON-AQUEOUS PIGMENT DISPERSIONS AGFA GRAPHICS NV (BE) 2011-05-04 EP disclosed