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
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