SCHEMBL341546

SCHEMBL341546

O=C1COc2c[c]cnc2N1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.36
NR3C2 P08235 6/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
PARP1 P09874 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 2/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL29569 0.70 NPC1 (0.45) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL3435529 0.70 CYP11B1 (0.38) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL1564969 0.69 CHEK1 (0.44)
SCHEMBL910452 0.68 CRBN (0.39)
SCHEMBL859012 0.68 MMP12 (0.38) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL18307151 0.68 MMP12 (0.38) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL3082129 0.68 ALDH1A1 (0.38) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL75634 0.67 MMP12 (0.47) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL17095009 0.66 PARP1 (0.37) MMP12NR3C2ALDH1A1MAPTPARP1
SCHEMBL592791 0.66 NR3C2 (0.47) MMP12NR3C2ALDH1A1MAPTPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0462813-B1 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LTD (GB) 1995-10-25 EP claimed
US-5373007-A Lipoxygenase inhibitors ZENECA LIMITED (GB) 1994-12-13 US claimed
EP-0462813-A2 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LIMITED (GB) 1991-12-27 EP claimed
US-20220218705-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2022-07-14 US disclosed
US-20220024907-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2022-01-27 US disclosed
US-11220496-B2 Compounds and method for treating autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2022-01-11 US disclosed
US-11174251-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2021-11-16 US disclosed
EP-2598500-B1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS INC (US) 2021-05-19 EP disclosed
US-20200216431-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2020-07-09 US disclosed
US-20200115371-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2020-04-16 US disclosed
US-20200087293-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2020-03-19 US disclosed
US-20110190343-A1 HIV-1 FUSION INHIBITORS AND METHODS TOURO UNIVERSITY (US) 2011-08-04 US disclosed
US-20100190770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-29 US disclosed
WO-2010085684-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-29 WO disclosed
US-20100158921-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-06-24 US disclosed
EP-0462813-B1 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LTD (GB) 1995-10-25 EP disclosed
US-5373007-A Lipoxygenase inhibitors ZENECA LIMITED (GB) 1994-12-13 US disclosed
US-5321025-A Inhibitors of 5-lipoxygenase IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-06-14 US disclosed
US-5217969-A Antiinflammatory, antiulcer agent IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-08 US disclosed
EP-0462813-A2 Bicyclic pyran derivatives and their use as inhibitors of 5-lipoxygenase ZENECA LIMITED (GB) 1991-12-27 EP 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 (10 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-11220496-B2 Compounds and method for treating autoimmune diseases NR1H2, CNR2, CNR1 MMP12 3138/4885NR3C2 52/4885ALDH1A1 2040/4885
US-20200115371-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 MMP12 2404/4885NR3C2 2862/4885ALDH1A1 3686/4885
US-20200216431-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 MMP12 2366/4885NR3C2 2869/4885ALDH1A1 3988/4885
US-20220218705-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES NR1H2, CNR2, CNR1 MMP12 3138/4885NR3C2 52/4885ALDH1A1 2040/4885
US-20100190770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 MMP12 2366/4885NR3C2 2869/4885ALDH1A1 3988/4885
US-20100158921-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 MMP12 2368/4885NR3C2 3650/4885ALDH1A1 4036/4885
US-20200087293-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES NR1H2, CNR2, CNR1 MMP12 3138/4885NR3C2 52/4885ALDH1A1 2040/4885
US-11174251-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 MMP12 2404/4885NR3C2 2862/4885ALDH1A1 3686/4885
US-20110190343-A1 HIV-1 FUSION INHIBITORS AND METHODS FLI1, API5, MAVS MMP12 2136/4885NR3C2 4820/4885ALDH1A1 3269/4885
US-20220024907-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 MMP12 2404/4885NR3C2 2862/4885ALDH1A1 3686/4885

“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.