SCHEMBL9550765

SCHEMBL9550765

CCOc1ccc(-c2c3ccccc3c(-c3ccc(OCC)cc3)c3cc(Br)ccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NQO1 P15559 1/20 0.42
LTA4H P09960 1/20 0.42
NPC1 O15118 4/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 3/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 4/20 0.41
MAPT P10636 5/20 0.41
GUSB P08236 1/20 0.40
PDGFRB P09619 1/20 0.39
RELA Q04206 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL15200921 0.85 NQO1 (0.58) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL9550766 0.83 MAPT (0.46) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL9957605 0.83 NQO1 (0.47) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL30662422 0.82 SMN1; SMN2 (0.57) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL30459370 0.82 MAPT (0.44) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL428140 0.82 MAPT (0.44) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL9550755 0.82 CYP1A2 (0.46) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL5098645 0.81 TTK (0.54) MEN1KMT2ANQO1LTA4HNPC1
SCHEMBL13241716 0.80 ALDH1A1 (0.46) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL27864700 0.78 CDC25A (0.55) MEN1KMT2ANQO1LTA4HNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0429821-A2 Chemiluminescent solution based on substituted anthracene AMERICAN CYANAMID COMPANY (US) 1991-06-05 EP claimed
US-5232635-A CHEMILUMINESCENT SOLUTION BASED ON SUBSTITUTED ANTHRACENS AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed
EP-0429821-A2 Chemiluminescent solution based on substituted anthracene AMERICAN CYANAMID COMPANY (US) 1991-06-05 EP disclosed