Sugi Predict

Sugi Predict / Compounds / SCHEMBL8242849

SCHEMBL8242849

SCHEMBL8242849

O=C(c1ccccc1)c1no[n+]([O-])c1C(=O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CATSPER1 Q8NEC5 2/20 1.00
▸ ALDH1A1 P00352 7/20 0.71
▸ HTT P42858 5/20 0.71
▸ MAPT P10636 5/20 0.71
▸ HPGD P15428 5/20 0.71
▸ MAPK1 P28482 3/20 0.71
▸ NPC1 O15118 3/20 0.71
▸ RAB9A P51151 3/20 0.71
▸ HSP90AA1 P07900 2/20 0.71
▸ MITF O75030 1/20 0.71
▸ LMNA P02545 3/20 0.66
▸ TP53 P04637 3/20 0.66
▸ HSD17B10 Q99714 3/20 0.66
▸ SMN1; SMN2 Q16637 3/20 0.66
▸ PTPN7 P35236 2/20 0.66
▸ KMT2A Q03164 3/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ DUSP3 P51452 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ PTPN22 Q9Y2R2 1/20 0.55

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
SCHEMBL14948955 0.91 CATSPER1 (0.82) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL15891247 0.83 ALDH1A1 (1.00) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL11605100 0.80 NPC1 (0.71) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL11604046 0.78 CATSPER1 (0.63) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL8370261 0.78 CATSPER1 (0.63) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL8372387 0.73 ALDH1A1 (0.58) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL15891186 0.71 ALDH1A1 (0.56) CATSPER1ALDH1A1HTTMAPTHPGD
SCHEMBL11150237 0.67 CATSPER1 (0.50) CATSPER1ALDH1A1HTTMAPTHPGD
Benzophenone SCHEMBL4382632 0.67 ALDH1A1 (0.93) ALDH1A1MAPTHPGDNPC1RAB9A
Benzophenone SCHEMBL28261660 0.67 ALDH1A1 (0.93) ALDH1A1MAPTHPGDNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118206598-A Rhodiola rosea glycoside derivative and preparation method and application thereof 中国药科大学 2024-06-18 — — CN claimed
CN-111233851-A Scopoletin benzenesulfonyl furazan nitrogen oxide derivative and preparation method and application thereof 中国药科大学 2020-06-05 — — CN claimed
CN-118206598-A Rhodiola rosea glycoside derivative and preparation method and application thereof 中国药科大学 2024-06-18 — — CN disclosed
CN-116063297-B Fraxinin derivative and preparation method and application thereof 中国药科大学 2023-12-22 — — CN disclosed
CN-116063297-A Fraxinin derivative and preparation method and application thereof 中国药科大学 2023-05-05 — — CN disclosed
CN-112538079-B Coumarin derivative and synthesis method and application thereof 中国药科大学 2022-12-27 — — CN disclosed
CN-114716450-A Bergenin derivative and preparation method and application thereof 中国药科大学 2022-07-08 — — CN disclosed
CN-112538079-A Coumarin derivative and synthesis method and application thereof 中国药科大学 2021-03-23 — — CN disclosed
CN-111233851-A Scopoletin benzenesulfonyl furazan nitrogen oxide derivative and preparation method and application thereof 中国药科大学 2020-06-05 — — CN disclosed
US-9994534-B2 Pain-relieving compositions and uses therefor THE UNIVERSITY OF QUEENSLAND (AU) 2018-06-12 — — US disclosed
US-20180111910-A1 PAIN-RELIEVING COMPOSITIONS AND USES THEREFOR THE UNIVERSITY OF QUEENSLAND (AU) 2018-04-26 — — US disclosed
US-8952041-B2 Modulators of sperm hypermobility and uses thereof HYDRA BIOSCIENCES, INC. (US) 2015-02-10 — — US disclosed
US-8822509-B2 Pain-relieving compositions and uses therefor THE UNIVERSITY OF QUEENSLAND (AU) 2014-09-02 — — US disclosed
US-20140206872-A1 FLUORESCENT DYE SHINICHIRO ISOBE (JP) 2014-07-24 — — US disclosed
US-20130123310-A1 MODULATORS OF SPERM HYPERMOBILITY AND USES THEREOF HYDRA BIOSCIENCES, INC. (US) 2013-05-16 — — US disclosed
US-8394840-B2 Modulators of sperm hypermotility and uses thereof HYDRA BIOSCIENCES, INC. (US) 2013-03-12 — — US disclosed
US-20090326017-A1 PAIN-RELIEVING COMPOSITIONS AND USES THEREFOR THE UNIVERSITY OF QUEENSLAND (AU) 2009-12-31 — — US disclosed
US-20070004785-A1 Modulators of sperm hypermotility and uses thereof HYDRA BIOSCIENCES, INC. (US) 2007-01-04 — — US disclosed
WO-2006138428-A2 MODULATORS OF SPERM HYPERMOTILITY AND USES THEREOF HYDRA BIOSCIENCES, INC. (US) 2006-12-28 — — WO disclosed
US-4089867-A Preparation of diacylfurazan oxides TEXACO INC. (US) 1978-05-16 — — 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 (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-20130123310-A1 MODULATORS OF SPERM HYPERMOBILITY AND USES THEREOF CATSPER1, SPAG5, NASP CATSPER1 1/4885ALDH1A1 630/4885HTT 331/4885
US-20070004785-A1 Modulators of sperm hypermotility and uses thereof CATSPER1, SPAG5, ITPR3 CATSPER1 1/4885ALDH1A1 807/4885HTT 233/4885
US-20090326017-A1 PAIN-RELIEVING COMPOSITIONS AND USES THEREFOR NOS2, NOS1, NOS3 CATSPER1 330/4885ALDH1A1 822/4885HTT 2104/4885
US-20180111910-A1 PAIN-RELIEVING COMPOSITIONS AND USES THEREFOR NOS2, NOS1, NOS3 CATSPER1 509/4885ALDH1A1 1192/4885HTT 2661/4885
US-20140206872-A1 FLUORESCENT DYE MB, NCL, NEFM CATSPER1 1799/4885ALDH1A1 3240/4885HTT 949/4885

“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.