SCHEMBL12514992

SCHEMBL12514992

COC(=O)c1ccc(C(=O)N[C@@H](CCCCN)C(=O)Nc2ccc(OC)c(C(=O)N[C@@H](CCCCN)C(=O)Nc3ccc(OC)c(C(=O)N[C@@H](CCCCN)C(=O)Nc4ccc(OC)c(C(=O)N[C@@H](CCCCN)C(=O)Nc5ccc(OC)c(C(N)=O)c5)c4)c3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 2/20 0.51
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MMP2 P08253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ERAP2 Q6P179 5/20 0.41
▸ LNPEP Q9UIQ6 4/20 0.41
▸ HPGDS O60760 1/20 0.41
▸ ERAP1 Q9NZ08 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ PRMT1 Q99873 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TAS1R3 Q7RTX0 1/20 0.39
▸ TAS1R1 Q7RTX1 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
SCHEMBL18116742 0.93 KLKB1 (0.46) KLKB1MEN1KMT2AMMP2MAPT
SCHEMBL12515249 0.92 KLKB1 (0.45) KLKB1MEN1KMT2AMMP2MAPT
SCHEMBL12515244 0.92 HDAC1 (0.47) KLKB1MEN1KMT2AMMP2ERAP2
SCHEMBL19445793 0.92 HDAC1 (0.47) KLKB1MEN1KMT2AMMP2ERAP2
SCHEMBL19486027 0.91 KLKB1 (0.45) KLKB1MEN1KMT2AMMP2MAPT
SCHEMBL19944728 0.91 KLKB1 (0.45) KLKB1MEN1KMT2AMMP2MAPT
SCHEMBL10260997 0.91 ERAP2 (0.49) KLKB1MMP2ERAP2LNPEPHPGDS
SCHEMBL19219853 0.91 HDAC1 (0.48) MMP2ERAP2LNPEPERAP1KDM4E
SCHEMBL21371960 0.91 HDAC1 (0.48) MMP2ERAP2LNPEPERAP1KDM4E
SCHEMBL19218174 0.90 ERAP2 (0.49) KLKB1MMP2ERAP2LNPEPHPGDS

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 15 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-20160213668-A1 Compounds for use in Treatment of Mucostis INNOVATION PHARMACEUTICALS INC. 2016-07-28 — — 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
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 (9 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 KLKB1 1324/4885MEN1 2352/4885KMT2A 3256/4885
US-10603294-B2 Compounds for use in treatment of mucositis MUC1, FUT6, MMP8 KLKB1 1324/4885MEN1 2352/4885KMT2A 3256/4885
US-20140364364-A1 COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS MUC1, FUT6, MMP8 KLKB1 1324/4885MEN1 2352/4885KMT2A 3256/4885
US-20120295922-A1 Compounds For Use In Treatment Of Mucositis MUC1, FUT6, MMP8 KLKB1 1324/4885MEN1 2352/4885KMT2A 3256/4885
US-10206894-B2 Compounds for use in treatment of mucositis MUC1, FUT6, SI KLKB1 1370/4885MEN1 4264/4885KMT2A 3326/4885
US-20110178104-A1 Anti-Heparin Compounds SERPINC1, CFH, SERPINH1 KLKB1 302/4885MEN1 1003/4885KMT2A 2766/4885
US-20190282521-A1 Compounds For Use In Treatment Of Mucositis MUC1, FUT6, MMP8 KLKB1 1324/4885MEN1 2352/4885KMT2A 3256/4885
US-20180064664-A1 Compounds For Use In Treatment of Mucositis MUC1, FUT6, SI KLKB1 1370/4885MEN1 4264/4885KMT2A 3326/4885
US-20160213668-A1 Compounds for use in Treatment of Mucostis MUC1, SOST, ALG1 KLKB1 1372/4885MEN1 756/4885KMT2A 3424/4885

“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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