SCHEMBL2199664

SCHEMBL2199664

Cc1cc(C)c([PH](=O)O)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MMP13 P45452 1/20 0.37
RAPGEF4 Q8WZA2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
PRSS1 P07477 2/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TPMT P51580 1/20 0.33
F2 P00734 1/20 0.33

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
SCHEMBL544371 0.78 RAPGEF4 (0.39) CA1CA2MMP1MMP2MMP9
SCHEMBL14246534 0.74 RAPGEF4 (0.36) CA1CA2MMP1MMP2MMP9
SCHEMBL3188407 0.72 RAPGEF4 (0.39) CA1CA2MMP1MMP2MMP9
SCHEMBL8389828 0.72 CYP3A4 (0.45) ALDH1A1LMNAGAAMAPTTP53
SCHEMBL28264040 0.70 ALDH1A1 (0.41) ALDH1A1PRSS1PRSS2PRSS3TDP1
SCHEMBL27509216 0.70 RAPGEF4 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL562789 0.69 TDP1 (0.44) RAPGEF4ALDH1A1KDM4EGAAMAPT
SCHEMBL30107908 0.69 HTR1D (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL4244313 0.69 TAS1R3 (0.38) CA1CA2MMP1MMP2MMP9
Ammonia Solution, Strong SCHEMBL17670042 0.68 ALDH1A1 (0.39) ALDH1A1PRSS1PRSS2PRSS3TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5245005-A Amine end groups, phosphinic acid catalyst MONSANTO COMPANY (US) 1993-09-14 US claimed
CN-110989200-A Colorant compositions for tinted contact lenses, and methods of modifying tinted contact lens colorants 明基材料股份有限公司 2020-04-10 CN disclosed
EP-1734088-B1 ACTIVE ENERGY RADIATION HARDENABLE WATER BASE INK COMPOSITION AND UTILIZING THE SAME, METHOD OF INKJET RECORDING, INK CARTRIDGE, RECORDING UNIT AND INKJET RECORDING APPARATUS CANON KK (JP) 2015-05-13 EP disclosed
US-7976148-B2 Active energy ray curable aqueous ink composition, and inkjet recording method, ink cartridge, recording unit, and inkjet recording apparatus using the same CANON KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-20090136680-A1 ACTIVE ENERGY RAY CURABLE AQUEOUS INK COMPOSITION, AND INKJET RECORDING METHOD, INK CARTRIDGE, RECORDING UNIT, AND INKJET RECORDING APPARATUS USING THE SAME CANON KABUSHIKI KAISHA (JP) 2009-05-28 US disclosed
US-7503649-B2 Active energy ray curable aqueous ink composition, and inkjet recording method, ink cartridge, recording unit, and inkjet recording apparatus using the same CANON KABUSHIKI KAISHA (JP) 2009-03-17 US disclosed
EP-1734088-A1 ACTIVE ENERGY RADIATION HARDENABLE WATER BASE INK COMPOSITION AND UTILIZING THE SAME, METHOD OF INKJET RECORDING, INK CARTRIDGE, RECORDING UNIT AND INKJET RECORDING APPARATUS Canon Kabushiki Kaisha (JP) 2006-12-20 EP disclosed
US-20060004116-A1 Active energy ray curable aqueous ink composition, and inkjet recording method, ink cartridge, recording unit, and inkjet recording apparatus using the same CANON KABUSHIKI KAISHA (JP) 2006-01-05 US disclosed
EP-0487343-B1 Process for preparing a lithographic plate FUJI PHOTO FILM CO LTD (JP) 1999-04-28 EP disclosed
US-5245005-A Amine end groups, phosphinic acid catalyst MONSANTO COMPANY (US) 1993-09-14 US disclosed
EP-0487343-A1 Process for preparing a lithographic plate Fuji Photo Film Co., Ltd. (JP) 1992-05-27 EP disclosed