SCHEMBL7003046

SCHEMBL7003046

Cc1ccc(Nc2ccc(O)cc2C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
G6PD P11413 1/20 0.53
RAPGEF4 Q8WZA2 2/20 0.52
ALDH1A1 P00352 4/20 0.51
MAPT P10636 4/20 0.51
KDM4E B2RXH2 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALOX15 P16050 2/20 0.51
LMNA P02545 1/20 0.51
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
RUNX1 Q01196 1/20 0.51
CBFB Q13951 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYTH2 Q99418 1/20 0.46
MAPKAPK2 P49137 1/20 0.46
TNIK Q9UKE5 3/20 0.45

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
SCHEMBL11563580 0.89 RAPGEF4 (0.55) GAAMEN1KMT2AL3MBTL1G6PD
SCHEMBL7003152 0.85 GAA (0.60) GAAMEN1KMT2ARAPGEF4ALDH1A1
SCHEMBL7003942 0.84 RAPGEF4 (0.64) GAAMEN1KMT2ARAPGEF4ALDH1A1
SCHEMBL5667044 0.84 RAPGEF4 (0.63) GAAMEN1KMT2AL3MBTL1G6PD
SCHEMBL30146931 0.84 RAPGEF4 (0.63) GAAMEN1KMT2AL3MBTL1G6PD
SCHEMBL7644039 0.83 GAA (0.61) GAAMEN1KMT2ARAPGEF4ALDH1A1
SCHEMBL11555581 0.82 GAA (0.61) GAAMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL5028501 0.82 RAPGEF4 (0.61) GAAMEN1KMT2AL3MBTL1G6PD
SCHEMBL28260920 0.81 GAA (0.53) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL11009117 0.81 GAA (0.46) GAAMEN1KMT2AL3MBTL1G6PD

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 13 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
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
EP-0112710-B1 FLUORAN DERIVATIVES KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1987-08-26 EP disclosed
EP-0176161-A1 Novel fluoran compounds and production and use thereof TAOKA CHEMICAL CO., LTD (JP) 1986-04-02 EP disclosed
US-4536220-A PHOTOSTABILITY, DISCOLORATION INHIBITION KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1985-08-20 US disclosed
EP-0112710-A1 Fluoran derivatives KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1984-07-04 EP disclosed
US-4156682-A Fluoran compounds and recording sheet containing them SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-05-29 US disclosed
US-4024157-A Fluoran compounds and recording sheet containing them SUMITOMO CHEMICAL COMPANY LIMITED (JA) 1977-05-17 US disclosed