SCHEMBL12515474

SCHEMBL12515474

COc1ccc(NC(=O)[C@H](CCCCN)NC(=O)c2cc(NC(=O)[C@H](CCCCN)NC(=O)c3cc(NC(=O)[C@H](CCCCN)NC(=O)c4cc(NC(=O)[C@@H](N)CCC(=O)O)ccc4OC)ccc3OC)ccc2OC)cc1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 5/20 0.47
▸ S1PR1 P21453 2/20 0.42
▸ ERAP2 Q6P179 5/20 0.42
▸ LNPEP Q9UIQ6 4/20 0.42
▸ S1PR3 Q99500 1/20 0.41
▸ ERAP1 Q9NZ08 3/20 0.41
▸ SUV39H2 Q9H5I1 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ LTA4H P09960 1/20 0.39

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
SCHEMBL19445788 1.00 MMP2 (0.47) MMP2S1PR1ERAP2LNPEPS1PR3
SCHEMBL17949785 0.99 MMP2 (0.49) MMP2S1PR1ERAP2LNPEPS1PR3
SCHEMBL12515487 0.97 MMP2 (0.49) MMP2S1PR1ERAP2LNPEPERAP1
SCHEMBL12515485 0.97 MMP2 (0.49) MMP2S1PR1ERAP2LNPEPERAP1
SCHEMBL12515481 0.97 MMP2 (0.49) MMP2S1PR1ERAP2LNPEPERAP1
SCHEMBL19944937 0.97 MMP2 (0.48) MMP2S1PR1ERAP2LNPEPS1PR3
SCHEMBL19486009 0.95 MMP2 (0.44) MMP2S1PR1ERAP2LNPEPS1PR3
Delparantag SCHEMBL10267622 0.94 ERAP2 (0.47) MMP2ERAP2LNPEPERAP1SUV39H2
Delparantag SCHEMBL19445838 0.94 ERAP2 (0.47) MMP2ERAP2LNPEPERAP1SUV39H2
SCHEMBL15138936 0.94 ERAP2 (0.47) MMP2ERAP2LNPEPERAP1SUV39H2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10603294-B2 Compounds for use in treatment of mucositis INNOVATION PHARMACEUTICALS INC. (US) 2020-03-31 — — US disclosed
US-20190282521-A1 Compounds For Use In Treatment Of Mucositis POLYMEDIX, INC. 2019-09-19 — — US disclosed
US-10206894-B2 Compounds for use in treatment of mucositis INNOVATION PHARMACEUTICALS INC. (US) 2019-02-19 — — US disclosed
US-20180064664-A1 Compounds For Use In Treatment of Mucositis POLYMEDIX, INC. 2018-03-08 — — US disclosed
US-9795575-B2 Compounds for use in treatment of mucositis INNOVATION PHARMACEUTICALS INC. (US) 2017-10-24 — — US disclosed
EP-2709619-B1 COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS CELLCEUTIX CORP (US) 2017-10-11 — — EP disclosed
US-20170224640-A1 Compounds For Use In Treatment Of Mucositis INNOVATION PHARMACEUTICALS INC. 2017-08-10 — — US disclosed
US-20170224640-A1 Compounds For Use In Treatment Of Mucositis INNOVATION PHARMACEUTICALS INC. 2017-08-10 — — US disclosed
US-9457027-B2 Compounds for use in treatment of mucostis CELLCEUTIX CORPORATION (US) 2016-10-04 — — US disclosed
US-9155738-B2 Compounds for use in treatment of mucostitis CELLCEUTIX CORPORATION (US) 2015-10-13 — — US disclosed
US-20140364364-A1 COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS INNOVATION PHARMACEUTICALS INC. 2014-12-11 — — US disclosed
US-8802683-B2 Compounds for use in treatment of mucositis CELLCEUTIX CORPORATION (US) 2014-08-12 — — US disclosed
US-20120295922-A1 Compounds For Use In Treatment Of Mucositis POLYMEDIX, INC. (US) 2012-11-22 — — US disclosed
WO-2012158672-A2 COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS POLYMEDIX, INC. (US) 2012-11-22 — — WO disclosed
US-20110178104-A1 Anti-Heparin Compounds POLYMEDIX INC. (US) 2011-07-21 — — US disclosed
WO-2011084970-A1 ANTI-HEPARIN COMPOUNDS POLYMEDIX INC. (US) 2011-07-14 — — 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 (8 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-20170224640-A1 Compounds For Use In Treatment Of Mucositis MUC1, FUT6, MMP8 MMP2 367/4885S1PR1 543/4885ERAP2 646/4885
US-10603294-B2 Compounds for use in treatment of mucositis MUC1, FUT6, MMP8 MMP2 367/4885S1PR1 543/4885ERAP2 646/4885
US-20140364364-A1 COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS MUC1, FUT6, MMP8 MMP2 367/4885S1PR1 543/4885ERAP2 646/4885
US-20120295922-A1 Compounds For Use In Treatment Of Mucositis MUC1, FUT6, MMP8 MMP2 367/4885S1PR1 543/4885ERAP2 646/4885
US-10206894-B2 Compounds for use in treatment of mucositis MUC1, FUT6, SI MMP2 595/4885S1PR1 1574/4885ERAP2 692/4885
US-20110178104-A1 Anti-Heparin Compounds SERPINC1, CFH, SERPINH1 MMP2 174/4885S1PR1 2383/4885ERAP2 325/4885
US-20190282521-A1 Compounds For Use In Treatment Of Mucositis MUC1, FUT6, MMP8 MMP2 367/4885S1PR1 543/4885ERAP2 646/4885
US-20180064664-A1 Compounds For Use In Treatment of Mucositis MUC1, FUT6, SI MMP2 595/4885S1PR1 1574/4885ERAP2 692/4885

“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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