SCHEMBL3226085

SCHEMBL3226085

COc1ccc(OC)c2c1C(=N)NC2=N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.45
CA1 P00915 6/20 0.45
CA7 P43166 5/20 0.45
CA9 Q16790 5/20 0.45
KDM4E B2RXH2 6/20 0.41
MAPT P10636 4/20 0.41
MAPK1 P28482 2/20 0.41
S1PR4 O95977 1/20 0.41
HSP90AA1 P07900 1/20 0.41
G6PD P11413 1/20 0.41
S1PR1 P21453 1/20 0.41
OPRK1 P41145 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
MCL1 Q07820 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
TLR9 Q9NR96 1/20 0.41

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
SCHEMBL7830178 0.79 CA1 (0.46) CA2CA1CA7CA9KDM4E
SCHEMBL11617484 0.76 ACHE (0.40) CA9KDM4EMAPTALDH1A1MEN1
SCHEMBL3215387 0.75 ALDH1A1 (0.39) KDM4EMAPTMAPK1S1PR1RAB9A
SCHEMBL11861809 0.72 PDE4B (0.34) CA2MAPTNPSR1ALDH1A1MEN1
SCHEMBL1477960 0.71 CA1 (0.50) CA2CA1CA7CA9KDM4E
SCHEMBL7964993 0.70 CA1 (0.56) CA2CA1CA7CA9KDM4E
SCHEMBL11345733 0.67 POLB (0.38) ALDH1A1TDP1ACHECASP1POLB
SCHEMBL7825538 0.66 PDK2 (0.39) CA2CA1CA7CA9KDM4E
SCHEMBL11134106 0.65 MAPT (0.73) CA2CA1CA7CA9KDM4E
SCHEMBL28148154 0.64 CA1 (0.65) CA2CA1CA7CA9KDM4E

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 19 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-2554392-B1 HEAT-SENSITIVE RECORDING MATERIAL AND METHOD FOR MANUFACTURING THE SAME MITSUBISHI PAPER MILLS LTD (JP) 2016-05-11 EP disclosed
US-8623785-B2 Thermal recording material and method for producing the same MITSUBISHI PAPER MILLS LIMITED (JP) 2014-01-07 US disclosed
US-20130053240-A1 THERMAL RECORDING MATERIAL AND METHOD FOR PRODUCING THE SAME MITSUBISHI PAPER MILLS LIMITED (JP) 2013-02-28 US disclosed
EP-2554392-A1 HEAT-SENSITIVE RECORDING MATERIAL AND METHOD FOR MANUFACTURING THE SAME Mitsubishi Paper Mills Limited (JP) 2013-02-06 EP disclosed
US-8183175-B2 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2012-05-22 US disclosed
US-20100062195-A1 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2010-03-11 US disclosed
US-20070026259-A1 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2007-02-01 US disclosed
US-7005518-B2 Phthalocyanine dyes LI-COR, INC. (US) 2006-02-28 US disclosed
US-20040171827-A1 Phthalocyanine dyes LI-COR, INC. 2004-09-02 US disclosed
WO-2004038378-A2 PHTHALOCYANINE DYES LI-COR, INC. (US) 2004-05-06 WO disclosed
US-5804529-A HEAT SENSITIVE RECORDING LAYER; BETWEEN TWO POLYMERIC OXYGEN BARRIER LAYERS MITSUBISHI PAPER MILLS LTD. (JP) 1998-09-08 US disclosed
US-4122261-A Polycyclic iminoisoindoline chelates STERLING DRUG INC. (US) 1978-10-24 US disclosed
US-4066653-A 1-IMINO-3-(4-IMINO-5-THIAZOLIDINYLIDENE)ISOINDOLINES STERLING DRUG INC. (US) 1978-01-03 US disclosed
US-3993658-A Thiazolidinylidene-isoindolines STERLING DRUG INC. (US) 1976-11-23 US disclosed
US-3966753-A Thiazolidinylidene isoindoline pigments STERLING DRUG INC. (US) 1976-06-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040171827-A1 Phthalocyanine dyes SCLY, ALPL, PPIP5K2 CA2 900/4885CA1 264/4885CA7 87/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.