SCHEMBL6557129

SCHEMBL6557129

COc1ccccc1C(CCl)C(=O)C(CCl)c1ccccc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.42
CTSD P07339 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL7293335 0.87 MEN1 (0.46) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL7181205 0.86 POLB (0.46) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL27598847 0.82 POLB (0.49) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL27830794 0.82 POLB (0.49) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL28022832 0.82 POLB (0.49) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL29889833 0.79 POLB (0.53) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL1999919 0.79 POLB (0.53) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL6657928 0.77 POLB (0.47) POLBHTTNPSR1L3MBTL1SMN1; SMN2
Hydrochloric Acid SCHEMBL6409959 0.76 POLB (0.46) POLBHTTNPSR1L3MBTL1SMN1; SMN2
SCHEMBL30669705 0.76 POLB (0.48) POLBHTTNPSR1L3MBTL1SMN1; SMN2

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
EP-1423691-A1 FLUORESCENCE BASED OXYGEN SENSOR SYSTEMS 3M Innovative Properties Company (US) 2004-06-02 EP disclosed
WO-2003019179-A1 FLUORESCENCE BASED OXYGEN SENSOR SYSTEMS 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-03-06 WO disclosed