SCHEMBL3276451

SCHEMBL3276451

Cc1ccccc1-c1c(C)ccc(C(=O)O)c1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.59
MAPK1 P28482 4/20 0.57
MAPT P10636 3/20 0.57
KMT2A Q03164 3/20 0.57
ALDH1A1 P00352 3/20 0.57
MEN1 O00255 2/20 0.57
THRB P10828 2/20 0.57
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.57
RECQL P46063 1/20 0.57
KDM4E B2RXH2 4/20 0.47
MCL1 Q07820 2/20 0.47
USP2 O75604 1/20 0.47
PKM P14618 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPK14 Q16539 1/20 0.43
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MMP14 P50281 1/20 0.42
FABP4 P15090 1/20 0.42

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
SCHEMBL3269427 0.83 MYC (0.59) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL3824310 0.82 ALDH1A1 (0.51) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL3824312 0.81 MYC (0.66) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL3271723 0.80 MYC (0.76) MYCMAPTKMT2AALDH1A1MEN1
SCHEMBL7851664 0.79 MYC (0.73) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL10789310 0.78 MYC (0.72) MYCMAPTKMT2AALDH1A1MEN1
SCHEMBL3824307 0.78 MYC (0.67) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL27907220 0.76 MYC (0.54) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL10713921 0.76 PTGS2 (0.43) MYCMAPK1MAPTKMT2AALDH1A1
SCHEMBL2930434 0.75 KDM4E (0.50) MYCMAPK1MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1920042-B1 PARTICLES CONTAINING PERFUME HAVING IMPROVED FRAGRANCED PROPERTIES HENKEL AG & CO KGAA (DE) 2010-06-23 EP disclosed
EP-2046929-A1 LIQUID SUPPORT Henkel AG & Co. KGaA (DE) 2009-04-15 EP disclosed
EP-2038391-A1 WASHING, CLEANING AND CARE PRODUCTS Henkel AG & Co. KGaA (DE) 2009-03-25 EP disclosed
WO-2008116509-A1 CLEANING AGENT HENKEL AG & CO. KGAA (DE) 2008-10-02 WO disclosed
EP-1928992-A1 CONSUMER PRODUCTS HAVING VARYING ODORS Henkel AG & Co. KGaA (DE) 2008-06-11 EP disclosed
WO-2008012140-A1 LIQUID SUPPORT HENKEL AG & CO. KGAA (DE) 2008-01-31 WO disclosed
WO-2008003631-A1 WASHING, CLEANING AND CARE PRODUCTS HENKEL AG & CO. KGAA (DE) 2008-01-10 WO disclosed
WO-2007118747-A1 AQUEOUS CLEANING AGENT CONTAINING PERFUME HENKEL AG & CO. KGAA (DE) 2007-10-25 WO disclosed
WO-2007028479-A1 CONSUMER PRODUCTS HAVING VARYING ODORS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed