SCHEMBL11580805

SCHEMBL11580805

O=C1c2ccccc2C(=O)c2c1ccc(Oc1cccc3ccccc13)c2Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 4/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
DNMT1 P26358 1/20 0.43
ADORA2A P29274 2/20 0.43
NPC1 O15118 2/20 0.42
ESRRA P11474 1/20 0.41
KDM4E B2RXH2 3/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KCNA3 P22001 1/20 0.39
USP2 O75604 1/20 0.38
DUSP3 P51452 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 1/20 0.37
PTPN1 P18031 1/20 0.37

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
SCHEMBL27644911 0.85 MAPT (0.59) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL4462792 0.82 ALDH1A1 (0.62) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL11581930 0.80 ALDH1A1 (0.54) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL11580802 0.79 ALDH1A1 (0.49) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL11303111 0.78 ADORA2A (0.68) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL11581927 0.75 MAPT (0.44) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL11584406 0.74 ADORA2A (0.56) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL6902878 0.74 RAB9A (0.68) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL6415480 0.73 KCNA3 (0.57) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL11580799 0.71 PABPC1 (0.45) MAPTMEN1KMT2AALDH1A1RAB9A

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-4126626-A DYES, POLYESTERS CIBA-GEIGY CORPORATION (US) 1978-11-21 US disclosed