SCHEMBL2955031

SCHEMBL2955031

C1=Cc2cc3ccc([nH]3)c(-c3ncc[nH]3)c3nc(cc4ccc(cc1n2)[nH]4)C=C3

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.52
▸ STAT1 P42224 1/20 0.52
▸ NISCH Q9Y2I1 2/20 0.32
▸ MTOR P42345 1/20 0.32
▸ ADK P55263 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ ADRA2A P08913 1/20 0.31
▸ CYCS P99999 1/20 0.31
▸ TOP1 P11387 1/20 0.30

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
SCHEMBL2963039 0.96 STAT3 (0.50) STAT3STAT1NISCHMTORADK
SCHEMBL3520923 0.86 STAT3 (0.42) STAT3STAT1
SCHEMBL2963034 0.84 NISCH (0.36) STAT3STAT1NISCHMTORADK
SCHEMBL4732325 0.81 TOP1 (0.43) NISCHMTORADKCYCSTOP1
SCHEMBL29834821 0.79 IDO1 (0.36) STAT3STAT1NISCHMTORADK
SCHEMBL2955029 0.79 IDO1 (0.36) STAT3STAT1NISCHMTORADK
SCHEMBL460724 0.78 STAT3 (0.59) STAT3STAT1MTOR
SCHEMBL5470455 0.78 STAT3 (0.66) STAT3STAT1CYCSTOP1
SCHEMBL2962139 0.78 IDO1 (0.35) STAT3STAT1NISCHMTORADK
Hydrochloric Acid SCHEMBL5596534 0.77 STAT3 (0.53) STAT3STAT1TOP1

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103102353-A Free porphyrin, and preparation method and application thereof UNIV NORTHWESTERN 2013-05-15 — — CN claimed
US-7022840-B2 Porphyrin array exhibiting large two photon absorption property and including, as structural unit, bis (imidazolylporphyrin metal complex) linked with acetylenic bond and the derivative thereof, and method of producing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2006-04-04 — — US claimed
US-20040106787-A1 Porphyrin array exhibiting large two photon absorption property and including, as structural unit, bis(imidazolylporphyrin metal complex) linked with acetylenic bond and the derivative thereof, and method of producing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2004-06-03 — — US claimed
US-6602998-B2 Connector for energy transfer devices; photosynthesis sytems; solar cells NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2003-08-05 — — US claimed
US-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-10-04 — — US claimed
EP-3983486-A1 SMALL CATIONIC ORTHO-5,15-DI-HETEROARYL-PORPHYRINS DERIVATIVES AND THEIR APPLICATIONS IN PHOTOINACTIVATION OF MICROORGANISMS Universidade de Coimbra (PT) 2022-04-20 — — EP disclosed
WO-2020250207-A1 SMALL CATIONIC ORTHO-5,15-DI-HETEROARYL-PORPHYRINS DERIVATIVES AND THEIR APPLICATIONS IN PHOTOINACTIVATION OF MICROORGANISMS UNIVERSIDADE DE COIMBRA (PT) 2020-12-17 — — WO disclosed
EP-1718201-B1 SUBSTITUTED PORPHYRINS UNIV DUKE (US) 2016-09-14 — — EP disclosed
US-20150344509-A1 SUBSTITUTED PORPHYRINS UNIV DUKE (US) 2015-12-03 — — US disclosed
US-9096628-B2 Substituted porphyrins DUKE UNIVERSITY (US) 2015-08-04 — — US disclosed
US-20140080797-A1 SUBSTITUTED PORPHYRINS DUKE UNIVERSITY (US) 2014-03-20 — — US disclosed
US-8618089-B2 Substituted porphyrins DUKE UNIVERSITY (US) 2013-12-31 — — US disclosed
US-6429310-B2 PHOTONIC OR ELECTRONIC ENERGY CONDUCTING NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2002-08-06 — — US disclosed
US-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-10-04 — — US disclosed
US-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-10-04 — — US disclosed
US-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-10-04 — — US disclosed
JP-2001253883-A NEW MERCAPTO-SUBSTITUTED IMIDAZOLYLPORPHYRIN METAL COMPLEX MONOMER, POLYMER HAVING THE SAME AS RECURRING UNIT AND METHOD FOR PRODUCING THE SAME NARA INSTITUTE OF SCIENCE & TECHNOLOGY 2001-09-18 — — JP disclosed
US-20010018515-A1 Poly(porphyrin) having imidazolyl porphyrin metal complex as unit NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-08-30 — — US disclosed
US-20010018515-A1 Poly(porphyrin) having imidazolyl porphyrin metal complex as unit NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-08-30 — — US disclosed
JP-2001213883-A POLY(PORPHYRIN) CONTAINING IMIDAZOLYLPORPHYRIN METAL COMPLEX AS CONSTITUENT UNIT NARA INSTITUTE OF SCIENCE & TECHNOLOGY 2001-08-07 — — JP 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 (5 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-20010018515-A1 Poly(porphyrin) having imidazolyl porphyrin metal complex as unit AP1M1, AP3M1, AP2M1 STAT3 2319/4885STAT1 3934/4885NISCH 3227/4885
US-20150344509-A1 SUBSTITUTED PORPHYRINS PPOX, FECH, MB STAT3 546/4885STAT1 729/4885NISCH 164/4885
US-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same AP1M1, MGAT3, AP3M1 STAT3 4014/4885STAT1 4596/4885NISCH 919/4885
US-20040106787-A1 Porphyrin array exhibiting large two photon absorption property and including, as structural unit, bis(imidazolylporphyrin metal complex) linked with acetylenic bond and the derivative thereof, and method of producing the same FTH1, CYC1, MDH2 STAT3 4023/4885STAT1 4451/4885NISCH 432/4885
US-20140080797-A1 SUBSTITUTED PORPHYRINS PPOX, FECH, MB STAT3 546/4885STAT1 729/4885NISCH 164/4885

“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.

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