SCHEMBL9734016

SCHEMBL9734016

COc1ccc(Cl)c(Cl)c1-c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.41
MAPT P10636 3/20 0.41
HSP90AA1 P07900 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 2/20 0.41
S1PR4 O95977 1/20 0.41
G6PD P11413 1/20 0.41
S1PR1 P21453 1/20 0.41
OPRK1 P41145 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
MCL1 Q07820 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
TLR9 Q9NR96 1/20 0.41
AHR P35869 4/20 0.41
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
HTR2B P41595 3/20 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
SCHEMBL7907219 0.78 HSP90AA1 (0.49) MAPK1MAPTHSP90AA1AHRALDH1A1
SCHEMBL29455135 0.78 AHR (0.52) MAPK1AHRALDH1A1
SCHEMBL4450440 0.78 AHR (0.52) MAPK1AHRALDH1A1
SCHEMBL7904037 0.73 AHR (0.42) MAPK1KDM4EAHRHTR2AHTR2C
SCHEMBL7905156 0.72 AHR (0.46) MAPK1MAPTHSP90AA1KDM4EAHR
SCHEMBL7897846 0.71 MAPK1 (0.57) MAPK1MAPTHSP90AA1NPSR1KDM4E
SCHEMBL9732658 0.71 MAPK1 (0.57) MAPK1MAPTHSP90AA1NPSR1RAB9A
SCHEMBL9732232 0.71 AHR (0.57) MAPK1MAPTHSP90AA1NPSR1RAB9A
SCHEMBL30715275 0.71 ALDH1A1 (0.46) MAPK1MAPTHSP90AA1NPSR1KDM4E
SCHEMBL53547 0.71 ALDH1A1 (0.46) MAPK1MAPTHSP90AA1NPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145790-A Immunoassay, fluorescein derivative ABBOTT LABORATORIES (US) 1992-09-08 US disclosed
EP-0455058-A2 Reagents and method for detecting polychlorinated biphenyls ABBOTT LABORATORIES (US) 1991-11-06 EP disclosed