SCHEMBL7001784

SCHEMBL7001784

Nc1ccc(OC(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.53
MAOB P27338 4/20 0.53
RAB9A P51151 2/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPC1 O15118 1/20 0.50
PPARG P37231 12/20 0.44
PPARA Q07869 10/20 0.44
EPHX1 P07099 1/20 0.43
F2 P00734 1/20 0.43

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
SCHEMBL11292923 0.86 PPARG (0.50) PPARGPPARAEPHX1
SCHEMBL7324691 0.77 NR4A1 (0.57) PPARGPPARA
SCHEMBL27615240 0.74 PPARG (0.46) MAOAPPARGPPARA
SCHEMBL8126114 0.74 MAOA (0.59) MAOAMAOBRAB9AGAAMAPT
Hydrochloric Acid SCHEMBL10773246 0.74 LMNA (0.47) PPARGPPARA
SCHEMBL7314137 0.74 PPARG (0.52) PPARGPPARA
SCHEMBL26124993 0.74 L3MBTL1 (0.50) MAOAMAOBRAB9AGAAMAPT
SCHEMBL10487486 0.73 PPARG (0.43) PPARGPPARA
SCHEMBL11757844 0.72 PPARG (0.42) PPARGPPARA
SCHEMBL9818873 0.72 PPARG (0.46) PPARGPPARA

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-6635602-B1 Heat sensitive and pressure sensitive recording material; synthesised directly by the reaction of two derivatives of amino phenols, phthalic anhydrides, keto acids and/or diphenylamines with a phenol derivative CIBA SPECIALTY CHEMICALS CORPORATION 2003-10-21 US disclosed
EP-1107972-B1 PREPARATION PROCESS FOR MANUFACTURE AND PURIFICATION OF MIXTURES OF FLUORAN COMPOUNDS AND RECORDING MATERIAL COMPRISING SAID MIXTURES OF FLUORAN CIBA SC HOLDING AG (CH) 2003-01-02 EP disclosed