SCHEMBL7001977

SCHEMBL7001977

CCCCCCCCNc1ccc(OC)cc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.68
MAPT P10636 3/20 0.68
ALDH1A1 P00352 1/20 0.54
PPARG P37231 1/20 0.53
CNR1 P21554 4/20 0.52
CNR2 P34972 3/20 0.52
BCHE P06276 1/20 0.50
APP P05067 1/20 0.49
ABL1 P00519 1/20 0.49
CHRM2 P08172 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KDM4E B2RXH2 1/20 0.47
THRB P10828 1/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL11327473 1.00 GAA (0.68) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL11335452 1.00 GAA (0.68) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL11333048 1.00 GAA (0.68) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL3631474 1.00 GAA (0.68) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL11338984 1.00 GAA (0.68) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL11225712 1.00 GAA (0.68) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL11331749 0.98 GAA (0.70) GAAMAPTALDH1A1PPARGCNR1
Cyclopropane SCHEMBL28852061 0.93 GAA (0.63) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL2097210 0.92 GAA (0.73) GAAMAPTALDH1A1PPARGCNR1
SCHEMBL2720066 0.86 ABL1 (0.59) MAPTALDH1A1ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5166350-A Process for the manufacture of fluoran compounds CIBA-GEIGY CORPORATION (US) 1992-11-24 US claimed
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
US-6566302-B1 For use in heat sensitive and pressure sensitive recording materials CIBA SPECIALTY CHEMICALS CORPORATION 2003-05-20 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
EP-1115579-B1 MONOPHASE SOLID SOLUTIONS COMPRISING A PLURALITY OF COLOUR FORMER COMPOUNDS AND PROCESS FOR THEIR PREPARATION CIBA SC HOLDING AG (CH) 2002-11-20 EP disclosed
EP-1115579-A1 MONOPHASE SOLID SOLUTIONS COMPRISING A PLURALITY OF COLOUR FORMER COMPOUNDS AND PROCESS FOR THEIR PREPARATION Ciba SC Holding AG (CH) 2001-07-18 EP disclosed
WO-2000026037-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-05-11 WO disclosed
WO-2000012318-A1 MONOPHASE SOLID SOLUTIONS COMPRISING A PLURALITY OF COLOUR FORMER COMPOUNDS AND PROCESS FOR THEIR PREPARATION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-03-09 WO disclosed
US-5166350-A Process for the manufacture of fluoran compounds CIBA-GEIGY CORPORATION (US) 1992-11-24 US disclosed
US-4349218-A PRESSURE AND HEAT SENSITIVE ELEMENTS; CARBONLESS REPRODUCTION GARNER ROBERT 1982-09-14 US disclosed
US-4302393-A LEUCO DYES FOR PRESSURE SENSITIVE AND THERMOREACTIVE RECORDING MATERIALS, GREEN CIBA-GEIGY CORPORATION (US) 1981-11-24 US disclosed
EP-0002721-B1 PROCESS FOR PREPARING HYDRAZINES BAYER AG (DE) 1981-09-02 EP disclosed
EP-0002721-A2 Process for preparing hydrazines BAYER AG (DE) 1979-07-11 EP disclosed
US-3957860-A SULFAMIC ACID CIBA-GEIGY AG (CH) 1976-05-18 US disclosed