SCHEMBL7817075

SCHEMBL7817075

N=C1NC(=N)c2c(Oc3ccccc3)cccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
KMT2A Q03164 2/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
HTR1A P08908 4/20 0.37
SLC6A2 P23975 4/20 0.37
SLC6A4 P31645 4/20 0.37
SLC6A3 Q01959 4/20 0.37
GAA P10253 1/20 0.37
LTA4H P09960 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL8918799 0.82 MAPT (0.39) LMNAKMT2APOLBMAPTMAPK1
SCHEMBL7828312 0.80 ALDH1A1 (0.41) KMT2AMAPTMAPK1SMN1; SMN2NPSR1
SCHEMBL27214951 0.78 LTA4H (0.42) LMNAKMT2AHTR1ASLC6A2SLC6A4
SCHEMBL7830178 0.77 CA1 (0.46) LMNAKMT2ATP53MAPTMAPK1
SCHEMBL1675994 0.74 TSHR (0.46) LMNAKMT2AMAPK1HTTNCOA1
SCHEMBL5506330 0.72 MAOA (0.51) LMNAKMT2ATP53POLBMAPT
SCHEMBL7827640 0.72
SCHEMBL7815949 0.72 PDK2 (0.46) KMT2AMAPTNPSR1GAAPTGS2
SCHEMBL11859777 0.72 HNF4A (0.37) MAPK1DPP4
SCHEMBL11833811 0.71 NCOA1 (0.53) LMNAKMT2AMAPK1HTTNCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213324-A1 COLORING COMPOSITION CONTAINING ISOINDOLINE COMPOUND AND USE OF SAME TOYO INK SC HOLDINGS CO., LTD. (JP) 2022-07-07 US disclosed
EP-3960824-A1 COLORING COMPOSITION CONTAINING ISOINDOLINE COMPOUND AND USE OF SAME Toyo Ink SC Holdings Co., Ltd. (JP) 2022-03-02 EP disclosed
CN-113710758-A Coloring composition containing isoindoline compound and use thereof 东洋油墨SC控股株式会社 2021-11-26 CN disclosed
WO-2020218262-A1 COLORING COMPOSITION CONTAINING ISOINDOLINE COMPOUND AND USE OF SAME 東洋インキSCホールディングス株式会社 2020-10-29 WO disclosed
EP-0679640-B1 Carboxylate and heat-sensitive recording material using same MITSUI CHEMICALS INC (JP) 2001-08-08 EP disclosed
US-5691272-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-11-25 US disclosed
US-5559247-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-24 US disclosed
EP-0679640-A1 Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-11-02 EP disclosed