Sugi Predict

Sugi Predict / Compounds / SCHEMBL5115377

SCHEMBL5115377

SCHEMBL5115377

O=[N+]([O-])c1ccc2sc3ccccc3c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ POLB P06746 1/20 0.51
▸ G6PD P11413 1/20 0.50
▸ TLR9 Q9NR96 1/20 0.50
▸ GPR3 P46089 1/20 0.50
▸ MAPT P10636 7/20 0.49
▸ S100A4 P26447 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ HPGD P15428 2/20 0.48
▸ PSMD14 O00487 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ CTSV O60911 1/20 0.47
▸ CTSL P07711 1/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ EGFR P00533 1/20 0.46

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
Methane SCHEMBL27594830 0.98 MAPT (0.50) PARP1SMN1; SMN2POLBG6PDTLR9
SCHEMBL11118149 0.91 SMN1; SMN2 (0.50) PARP1SMN1; SMN2POLBG6PDTLR9
SCHEMBL3083218 0.89 MAPT (0.55) PARP1SMN1; SMN2POLBGPR3MAPT
SCHEMBL472542 0.88 KDM4E (0.57) PARP1SMN1; SMN2POLBG6PDTLR9
SCHEMBL29724161 0.88 KDM4E (0.57) PARP1SMN1; SMN2POLBG6PDTLR9
SCHEMBL16857506 0.86 EGFR (0.50) PARP1SMN1; SMN2POLBG6PDTLR9
SCHEMBL783298 0.84 PGR (0.53) SMN1; SMN2POLBMAPTALDH1A1KMT2A
SCHEMBL8086574 0.81 CTSV (0.51) PARP1SMN1; SMN2POLBG6PDTLR9
SCHEMBL11714259 0.81 HSPB1 (0.47) SMN1; SMN2POLBG6PDTLR9MAPT
SCHEMBL17037091 0.79 MAPT (0.49) PARP1SMN1; SMN2POLBMAPTS100A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113960220-B Synchronous detection method and application of polycyclic aromatic hydrocarbon and derivatives thereof in blood 生态环境部华南环境科学研究所 2022-03-04 — — CN claimed
CN-113960220-A Synchronous detection method and application of polycyclic aromatic hydrocarbon and derivatives thereof in blood 生态环境部华南环境科学研究所 2022-01-21 — — CN claimed
CN-113960220-B Synchronous detection method and application of polycyclic aromatic hydrocarbon and derivatives thereof in blood 生态环境部华南环境科学研究所 2022-03-04 — — CN disclosed
CN-113960220-A Synchronous detection method and application of polycyclic aromatic hydrocarbon and derivatives thereof in blood 生态环境部华南环境科学研究所 2022-01-21 — — CN disclosed
CN-108658933-A A kind of preparation method of diaryl bithiophene type or diaryl sulfide type deuteroalkyl 南京大学 2018-10-16 — — CN disclosed
CN-108623545-A A kind of organic compound and its application and a kind of organic electroluminescence device 北京绿人科技有限责任公司 2018-10-09 — — CN disclosed
US-20170296682-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS THE JOHNS HOPKINS UNIVERSITY (US) 2017-10-19 — — US disclosed
US-20170296682-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS THE JOHNS HOPKINS UNIVERSITY (US) 2017-10-19 — — US disclosed
US-20170296682-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS THE JOHNS HOPKINS UNIVERSITY (US) 2017-10-19 — — US disclosed
US-20160235869-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS THE JOHNS HOPKINS UNIVERSITY (US) 2016-08-18 — — US disclosed
US-20160235869-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS THE JOHNS HOPKINS UNIVERSITY (US) 2016-08-18 — — US disclosed
US-4268596-A Electrophotographic element having 1,4-bis(azostyryl)-2,5 dimethoxy benzene compounds as photoconductors RICOH COMPANY, LTD. (JP) 1981-05-19 — — US disclosed
US-4260672-A Electrophotographic sensitive element having a photoconductive disazo pigment RICOH COMPANY, LTD. (JP) 1981-04-07 — — US disclosed
US-4251613-A LAMINATE OF CONDUCTIVE SUPPORT AND PHOTOSENSITIVE LAYER RICOH COMPANY, LTD. (JP) 1981-02-17 — — US disclosed
US-4251614-A CARBAZOLE DERIVATIVES RICOH COMPANY, LTD. (JP) 1981-02-17 — — US disclosed
US-4247614-A Electrophotographic element containing a disazo pigment RICOH CO., LTD. (JP) 1981-01-27 — — US disclosed
US-4242260-A ELECTROGRAPHY; PHOTOCONDUCTIVITY RICOH COMPANY, LTD. (JP) 1980-12-30 — — US disclosed
US-4229511-A Electrophotography with uniform exposure for residual potential RICOH COMPANY, LTD. (JP) 1980-10-21 — — US disclosed
US-4228231-A Color electrophotographic process, apparatus and recording element useful therein EASTMAN KODAK COMPANY (US) 1980-10-14 — — US disclosed
US-4106934-A ELECTROGRAPHY EASTMAN KODAK COMPANY (US) 1978-08-15 — — 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 (2 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-20170296682-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS CHRNA7, CHRNB2, CHRNB3 PARP1 4543/4885SMN1; SMN2 1145/4885POLB 4229/4885
US-20160235869-A1 DERIVATIVES OF DIBENZOTHIOPHENE IMAGING OF alpha-7 NICOTINIC ACETYLCHOLINE RECEPTORS CHRNA7, CHRNB2, CHRNB3 PARP1 4543/4885SMN1; SMN2 1145/4885POLB 4229/4885

“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.