Sugi Predict

Sugi Predict / Compounds / SCHEMBL4400467

SCHEMBL4400467

SCHEMBL4400467

CCN1CCCc2ccc(O)cc21

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 4/20 0.61
▸ CHRM4 P08173 3/20 0.61
▸ ESR1 P03372 2/20 0.51
▸ ESR2 Q92731 2/20 0.51
▸ HRH3 Q9Y5N1 2/20 0.51
▸ DRD1 P21728 7/20 0.45
▸ DRD2 P14416 6/20 0.45
▸ DRD5 P21918 6/20 0.45
▸ DRD3 P35462 5/20 0.45
▸ DRD4 P21917 4/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CHRM1 P11229 2/20 0.40
▸ CHRM3 P20309 2/20 0.40
▸ ACHE P22303 1/20 0.40

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
SCHEMBL14986037 0.95 CHRM2 (0.59) CHRM2CHRM4ESR1ESR2HRH3
SCHEMBL93954 0.90 ESR1 (0.54) CHRM2CHRM4ESR1ESR2HRH3
Hydrochloric Acid SCHEMBL11030093 0.88 ESR1 (0.52) CHRM2CHRM4ESR1ESR2HRH3
SCHEMBL8731853 0.87 HRH3 (0.51) CHRM2CHRM4ESR1ESR2HRH3
SCHEMBL17833063 0.81 ALDH1A1 (0.55) CHRM2CHRM4HRH3MEN1ALDH1A1
SCHEMBL4503966 0.81 CHRM2 (0.58) CHRM2CHRM4ESR1ESR2HRH3
SCHEMBL6683534 0.80 HRH3 (0.51) CHRM2CHRM4HRH3MEN1ALDH1A1
SCHEMBL19049049 0.80 HRH3 (0.51) CHRM2CHRM4HRH3MEN1ALDH1A1
SCHEMBL10901574 0.80 CHRM2 (0.57) CHRM2CHRM4DRD1DRD2DRD5
SCHEMBL9299712 0.80 CHRM2 (0.57) CHRM2CHRM4ESR1ESR2DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11939350-B2 Fluorescent dyes and methods of use thereof ENZO LIFE SCIENCES, INC. (US) 2024-03-26 — — US disclosed
EP-4204398-A2 CONJUGATES INCLUDING A DETECTABLE MOIETY Ventana Medical Systems, Inc. (US) 2023-07-05 — — EP disclosed
US-20230192658-A1 CONJUGATES INCLUDING A DETECTABLE MOIETY VENTANA MEDICAL SYSTEMS, INC. 2023-06-22 — — US disclosed
US-20230192658-A1 CONJUGATES INCLUDING A DETECTABLE MOIETY VENTANA MEDICAL SYSTEMS, INC. 2023-06-22 — — US disclosed
US-20230192658-A1 CONJUGATES INCLUDING A DETECTABLE MOIETY VENTANA MEDICAL SYSTEMS, INC. 2023-06-22 — — US disclosed
CN-115989221-A Conjugates comprising a detectable moiety 文塔纳医疗系统公司 2023-04-18 — — CN disclosed
US-11492359-B2 Near-infrared nerve-sparing fluorophores OREGON HEALTH & SCIENCE UNIVERSITY (US) 2022-11-08 — — US disclosed
WO-2022043491-A2 CONJUGATES INCLUDING A DETECTABLE MOIETY VENTANA MEDICAL SYSTEMS, INC. (US) 2022-03-03 — — WO disclosed
US-20210317137-A1 NEAR-INFRARED NERVE-SPARING FLUOROPHORES OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-10-14 — — US disclosed
US-20210317137-A1 NEAR-INFRARED NERVE-SPARING FLUOROPHORES OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-10-14 — — US disclosed
US-9416153-B2 Fluorescent dyes ENZO LIFE SCIENCES, INC. (US) 2016-08-16 — — US disclosed
EP-2768306-A1 FLUORESCENT DYES Enzo Life Sciences, Inc., c/o Enzo Biochem, Inc. (US) 2014-08-27 — — EP disclosed
WO-2013055647-A1 FLUORESCENT DYES ENZO LIFE SCIENCES, INC. (US) 2013-04-18 — — WO disclosed
US-20130089853-A1 FLUORESCENT DYES ENZO LIFE SCIENCES, INC., C/O ENZO BIOCHEM, INC. (US) 2013-04-11 — — US disclosed
US-8178360-B2 Dye compounds and the use of their labelled conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2012-05-15 — — US disclosed
US-20100009353-A1 Dye Compounds and the Use of their Labelled Conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2010-01-14 — — US disclosed
US-20070031336-A1 3H-phenoxazine derivatives suitable as near-infrared imaging agents, preparation an use thereof NOVARTIS AG (CH) 2007-02-08 — — US disclosed
EP-1658294-B1 3H-PHENOXAZINE DERIVATIVES SUITABLE AS NEAR-INFRARED IMAGING AGENTS, PREPARATION AN USE THEREOF NOVARTIS AG (CH) 2007-01-10 — — EP disclosed
EP-1658294-A1 3H-PHENOXAZINE DERIVATIVES SUITABLE AS NEAR-INFRARED IMAGING AGENTS, PREPARATION AN USE THEREOF Novartis AG (CH) 2006-05-24 — — EP disclosed
WO-2005016934-A1 3H-PHENOXAZINE DERIVATIVES SUITABLE AS NEAR-INFRARED IMAGING AGENTS, PREPARATION AN USE THEREOF NOVARTIS AG (CH) 2005-02-24 — — WO 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 (7 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-11492359-B2 Near-infrared nerve-sparing fluorophores NTRK1, PMP22, GAP43 CHRM2 855/4885CHRM4 971/4885ESR1 4030/4885
US-20230192658-A1 CONJUGATES INCLUDING A DETECTABLE MOIETY CD2BP2, CD47, CD44 CHRM2 4131/4885CHRM4 3039/4885ESR1 1349/4885
US-20130089853-A1 FLUORESCENT DYES KIT, TKFC, IK CHRM2 4741/4885CHRM4 4636/4885ESR1 2389/4885
US-20100009353-A1 Dye Compounds and the Use of their Labelled Conjugates HNRNPH3, DDB1, CD99 CHRM2 4670/4885CHRM4 4183/4885ESR1 3369/4885
US-20210317137-A1 NEAR-INFRARED NERVE-SPARING FLUOROPHORES NTRK1, NGF, SMN1; SMN2 CHRM2 1032/4885CHRM4 1278/4885ESR1 3482/4885
US-20070031336-A1 3H-phenoxazine derivatives suitable as near-infrared imaging agents, preparation an use thereof PSEN1, PSEN2, CHRM5 CHRM2 10/4885CHRM4 8/4885ESR1 677/4885
US-11939350-B2 Fluorescent dyes and methods of use thereof BCDIN3D, EFTUD2, IK CHRM2 4865/4885CHRM4 4739/4885ESR1 1258/4885

“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.